USER MOD reduce.3.24.130724 H: found=0, std=0, add=907, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 910 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 138 THR OG1 : rot -83:sc= -1.37 USER MOD Set 1.2: A 140 SER OG : rot 150:sc= -1.59 USER MOD Set 2.1: A 85 SER OG : rot -86:sc= 1.2 USER MOD Set 2.2: A 86 ASN : amide:sc= -2.1 K(o=-0.9,f=-3.1!) USER MOD Set 3.1: A 56 TYR OH : rot -120:sc= -1.22 USER MOD Set 3.2: A 118 HIS : no HE2:sc= -5.46! C(o=-6.7!,f=-10!) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0.00083) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -167:sc=-0.00473 (180deg=-0.0862) USER MOD Single : A 46 THR OG1 : rot 121:sc= -0.0858 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -2.57 X(o=-2.6,f=-2.9) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot -30:sc= 0.406 USER MOD Single : A 62 GLN : amide:sc= -0.521 X(o=-0.52,f=-0.043) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.0982 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -1.87 X(o=-1.9,f=-2.3!) USER MOD Single : A 87 ASN :FLIP amide:sc= -0.171 F(o=-1.2,f=-0.17) USER MOD Single : A 89 MET CE :methyl 167:sc= -0.0396 (180deg=-0.45) USER MOD Single : A 90 MET CE :methyl -149:sc= -3.85! (180deg=-4.25!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -1.56 K(o=-1.6,f=-3.3!) USER MOD Single : A 96 THR OG1 : rot 82:sc= 1.25 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -26:sc= -0.832 USER MOD Single : A 106 ASN :FLIP amide:sc= -3.17 F(o=-4,f=-3.2) USER MOD Single : A 107 LYS NZ :NH3+ -124:sc= 0 (180deg=-0.0213) USER MOD Single : A 110 TYR OH : rot 110:sc= -3.78 USER MOD Single : A 111 TYR OH : rot 100:sc= -1.07 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 1.07 K(o=1.1,f=-0.44) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN :FLIP amide:sc= -0.034 F(o=-0.54,f=-0.034) USER MOD Single : A 131 ASN : amide:sc= -5.79! C(o=-5.8!,f=-13!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS :FLIP no HD1:sc= -0.72 F(o=-2.3,f=-0.72) USER MOD Single : A 146 SER OG : rot -159:sc= -1.37 USER MOD Single : A 148 ASN : amide:sc= -2.24! C(o=-2.2!,f=-2.1!) USER MOD Single : A 150 HIS : no HD1:sc= -8.92! C(o=-8.9!,f=-10!) USER MOD Single : A 151 THR OG1 : rot 180:sc= -1.1 USER MOD Single : A 153 GLN :FLIP amide:sc= -5.39! C(o=-5.9!,f=-5.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 36 5.307 -11.487 9.461 1.00 0.00 N ATOM 2 CA ALA A 36 4.780 -11.683 8.085 1.00 0.00 C ATOM 3 C ALA A 36 5.653 -10.970 7.059 1.00 0.00 C ATOM 4 O ALA A 36 5.803 -11.433 5.929 1.00 0.00 O ATOM 5 CB ALA A 36 3.346 -11.184 7.995 1.00 0.00 C ATOM 0 HA ALA A 36 4.798 -12.750 7.863 1.00 0.00 H new ATOM 0 HB1 ALA A 36 2.972 -11.333 6.982 1.00 0.00 H new ATOM 0 HB2 ALA A 36 2.723 -11.738 8.697 1.00 0.00 H new ATOM 0 HB3 ALA A 36 3.314 -10.123 8.241 1.00 0.00 H new ATOM 13 N PHE A 37 6.228 -9.841 7.462 1.00 0.00 N ATOM 14 CA PHE A 37 7.088 -9.064 6.577 1.00 0.00 C ATOM 15 C PHE A 37 8.561 -9.278 6.915 1.00 0.00 C ATOM 16 O PHE A 37 9.410 -8.451 6.581 1.00 0.00 O ATOM 17 CB PHE A 37 6.744 -7.577 6.675 1.00 0.00 C ATOM 18 CG PHE A 37 5.284 -7.275 6.479 1.00 0.00 C ATOM 19 CD1 PHE A 37 4.547 -7.941 5.511 1.00 0.00 C ATOM 20 CD2 PHE A 37 4.650 -6.323 7.260 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.206 -7.661 5.327 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.309 -6.040 7.081 1.00 0.00 C ATOM 23 CZ PHE A 37 2.586 -6.709 6.113 1.00 0.00 C ATOM 0 H PHE A 37 6.114 -9.444 8.395 1.00 0.00 H new ATOM 0 HA PHE A 37 6.916 -9.406 5.556 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.054 -7.206 7.652 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.321 -7.031 5.929 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.026 -8.687 4.894 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.210 -5.795 8.018 1.00 0.00 H new ATOM 0 HE1 PHE A 37 2.643 -8.186 4.569 1.00 0.00 H new ATOM 0 HE2 PHE A 37 2.827 -5.296 7.698 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.538 -6.488 5.971 1.00 0.00 H new ATOM 33 N ALA A 38 8.860 -10.390 7.582 1.00 0.00 N ATOM 34 CA ALA A 38 10.230 -10.707 7.964 1.00 0.00 C ATOM 35 C ALA A 38 11.044 -11.184 6.768 1.00 0.00 C ATOM 36 O ALA A 38 12.169 -10.735 6.547 1.00 0.00 O ATOM 37 CB ALA A 38 10.242 -11.756 9.065 1.00 0.00 C ATOM 0 H ALA A 38 8.171 -11.085 7.868 1.00 0.00 H new ATOM 0 HA ALA A 38 10.692 -9.794 8.340 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.272 -11.983 9.340 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.709 -11.375 9.936 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.753 -12.663 8.709 1.00 0.00 H new ATOM 43 N ASP A 39 10.469 -12.102 6.002 1.00 0.00 N ATOM 44 CA ASP A 39 11.138 -12.650 4.826 1.00 0.00 C ATOM 45 C ASP A 39 10.883 -11.796 3.585 1.00 0.00 C ATOM 46 O ASP A 39 11.276 -12.166 2.478 1.00 0.00 O ATOM 47 CB ASP A 39 10.669 -14.084 4.574 1.00 0.00 C ATOM 48 CG ASP A 39 11.622 -15.112 5.151 1.00 0.00 C ATOM 49 OD1 ASP A 39 11.484 -15.444 6.347 1.00 0.00 O ATOM 50 OD2 ASP A 39 12.505 -15.587 4.406 1.00 0.00 O ATOM 0 H ASP A 39 9.539 -12.484 6.173 1.00 0.00 H new ATOM 0 HA ASP A 39 12.210 -12.646 5.023 1.00 0.00 H new ATOM 0 HB2 ASP A 39 9.680 -14.223 5.012 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.568 -14.247 3.501 1.00 0.00 H new ATOM 55 N ALA A 40 10.226 -10.654 3.769 1.00 0.00 N ATOM 56 CA ALA A 40 9.927 -9.759 2.658 1.00 0.00 C ATOM 57 C ALA A 40 11.178 -9.022 2.193 1.00 0.00 C ATOM 58 O ALA A 40 11.936 -8.493 3.007 1.00 0.00 O ATOM 59 CB ALA A 40 8.847 -8.766 3.057 1.00 0.00 C ATOM 0 H ALA A 40 9.892 -10.328 4.676 1.00 0.00 H new ATOM 0 HA ALA A 40 9.563 -10.363 1.827 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.634 -8.104 2.218 1.00 0.00 H new ATOM 0 HB2 ALA A 40 7.941 -9.305 3.333 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.191 -8.176 3.906 1.00 0.00 H new ATOM 65 N GLN A 41 11.388 -8.986 0.881 1.00 0.00 N ATOM 66 CA GLN A 41 12.547 -8.306 0.313 1.00 0.00 C ATOM 67 C GLN A 41 12.526 -6.825 0.672 1.00 0.00 C ATOM 68 O GLN A 41 11.562 -6.335 1.260 1.00 0.00 O ATOM 69 CB GLN A 41 12.578 -8.479 -1.206 1.00 0.00 C ATOM 70 CG GLN A 41 13.974 -8.711 -1.762 1.00 0.00 C ATOM 71 CD GLN A 41 14.197 -8.012 -3.089 1.00 0.00 C ATOM 72 OE1 GLN A 41 14.891 -6.998 -3.161 1.00 0.00 O ATOM 73 NE2 GLN A 41 13.608 -8.553 -4.149 1.00 0.00 N ATOM 0 H GLN A 41 10.772 -9.419 0.192 1.00 0.00 H new ATOM 0 HA GLN A 41 13.447 -8.754 0.734 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.942 -9.320 -1.481 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.152 -7.591 -1.674 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.711 -8.358 -1.041 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.138 -9.781 -1.887 1.00 0.00 H new ATOM 0 HE21 GLN A 41 13.041 -9.394 -4.043 1.00 0.00 H new ATOM 0 HE22 GLN A 41 13.722 -8.127 -5.069 1.00 0.00 H new ATOM 82 N THR A 42 13.592 -6.115 0.320 1.00 0.00 N ATOM 83 CA THR A 42 13.679 -4.691 0.614 1.00 0.00 C ATOM 84 C THR A 42 14.432 -3.941 -0.481 1.00 0.00 C ATOM 85 O THR A 42 15.251 -4.517 -1.198 1.00 0.00 O ATOM 86 CB THR A 42 14.364 -4.466 1.968 1.00 0.00 C ATOM 87 OG1 THR A 42 14.768 -5.698 2.540 1.00 0.00 O ATOM 88 CG2 THR A 42 13.479 -3.762 2.974 1.00 0.00 C ATOM 0 H THR A 42 14.402 -6.499 -0.166 1.00 0.00 H new ATOM 0 HA THR A 42 12.663 -4.299 0.656 1.00 0.00 H new ATOM 0 HB THR A 42 15.224 -3.831 1.754 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.204 -5.531 3.402 1.00 0.00 H new ATOM 0 HG21 THR A 42 14.023 -3.634 3.910 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.191 -2.785 2.585 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.585 -4.359 3.153 1.00 0.00 H new ATOM 96 N ARG A 43 14.146 -2.650 -0.595 1.00 0.00 N ATOM 97 CA ARG A 43 14.786 -1.799 -1.590 1.00 0.00 C ATOM 98 C ARG A 43 14.540 -0.331 -1.260 1.00 0.00 C ATOM 99 O ARG A 43 13.549 0.006 -0.614 1.00 0.00 O ATOM 100 CB ARG A 43 14.253 -2.117 -2.988 1.00 0.00 C ATOM 101 CG ARG A 43 14.864 -1.257 -4.082 1.00 0.00 C ATOM 102 CD ARG A 43 14.191 -1.500 -5.423 1.00 0.00 C ATOM 103 NE ARG A 43 12.766 -1.180 -5.386 1.00 0.00 N ATOM 104 CZ ARG A 43 11.881 -1.632 -6.272 1.00 0.00 C ATOM 105 NH1 ARG A 43 12.271 -2.421 -7.266 1.00 0.00 N ATOM 106 NH2 ARG A 43 10.604 -1.294 -6.164 1.00 0.00 N ATOM 0 H ARG A 43 13.469 -2.166 -0.005 1.00 0.00 H new ATOM 0 HA ARG A 43 15.859 -1.992 -1.573 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.446 -3.166 -3.212 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.171 -1.984 -2.994 1.00 0.00 H new ATOM 0 HG2 ARG A 43 14.772 -0.205 -3.813 1.00 0.00 H new ATOM 0 HG3 ARG A 43 15.929 -1.473 -4.164 1.00 0.00 H new ATOM 0 HD2 ARG A 43 14.679 -0.896 -6.188 1.00 0.00 H new ATOM 0 HD3 ARG A 43 14.321 -2.543 -5.710 1.00 0.00 H new ATOM 0 HE ARG A 43 12.429 -0.575 -4.637 1.00 0.00 H new ATOM 0 HH11 ARG A 43 13.253 -2.684 -7.354 1.00 0.00 H new ATOM 0 HH12 ARG A 43 11.589 -2.765 -7.942 1.00 0.00 H new ATOM 0 HH21 ARG A 43 10.300 -0.688 -5.402 1.00 0.00 H new ATOM 0 HH22 ARG A 43 9.926 -1.640 -6.843 1.00 0.00 H new ATOM 120 N LYS A 44 15.444 0.541 -1.691 1.00 0.00 N ATOM 121 CA LYS A 44 15.306 1.961 -1.416 1.00 0.00 C ATOM 122 C LYS A 44 14.362 2.637 -2.398 1.00 0.00 C ATOM 123 O LYS A 44 14.411 2.398 -3.605 1.00 0.00 O ATOM 124 CB LYS A 44 16.670 2.647 -1.439 1.00 0.00 C ATOM 125 CG LYS A 44 17.014 3.308 -0.121 1.00 0.00 C ATOM 126 CD LYS A 44 18.281 4.141 -0.224 1.00 0.00 C ATOM 127 CE LYS A 44 18.292 5.268 0.796 1.00 0.00 C ATOM 128 NZ LYS A 44 17.359 6.366 0.422 1.00 0.00 N ATOM 0 H LYS A 44 16.274 0.290 -2.228 1.00 0.00 H new ATOM 0 HA LYS A 44 14.875 2.059 -0.420 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.437 1.913 -1.684 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.682 3.396 -2.231 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.186 3.943 0.195 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.142 2.545 0.647 1.00 0.00 H new ATOM 0 HD2 LYS A 44 19.151 3.502 -0.071 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.363 4.557 -1.228 1.00 0.00 H new ATOM 0 HE2 LYS A 44 18.016 4.875 1.774 1.00 0.00 H new ATOM 0 HE3 LYS A 44 19.303 5.666 0.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 17.552 7.201 1.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 17.494 6.610 -0.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 16.378 6.055 0.574 1.00 0.00 H new ATOM 142 N LEU A 45 13.501 3.482 -1.852 1.00 0.00 N ATOM 143 CA LEU A 45 12.521 4.215 -2.637 1.00 0.00 C ATOM 144 C LEU A 45 13.161 5.406 -3.345 1.00 0.00 C ATOM 145 O LEU A 45 14.023 6.083 -2.786 1.00 0.00 O ATOM 146 CB LEU A 45 11.397 4.699 -1.718 1.00 0.00 C ATOM 147 CG LEU A 45 10.070 5.047 -2.404 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.745 4.051 -3.506 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.948 5.086 -1.380 1.00 0.00 C ATOM 0 H LEU A 45 13.462 3.679 -0.852 1.00 0.00 H new ATOM 0 HA LEU A 45 12.117 3.548 -3.399 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.206 3.927 -0.973 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.748 5.580 -1.181 1.00 0.00 H new ATOM 0 HG LEU A 45 10.170 6.032 -2.860 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.799 4.323 -3.975 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.538 4.065 -4.254 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.665 3.051 -3.080 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.010 5.334 -1.877 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.858 4.111 -0.901 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.170 5.841 -0.626 1.00 0.00 H new ATOM 161 N THR A 46 12.727 5.658 -4.576 1.00 0.00 N ATOM 162 CA THR A 46 13.250 6.771 -5.359 1.00 0.00 C ATOM 163 C THR A 46 12.500 8.058 -5.028 1.00 0.00 C ATOM 164 O THR A 46 11.348 8.019 -4.597 1.00 0.00 O ATOM 165 CB THR A 46 13.132 6.473 -6.855 1.00 0.00 C ATOM 166 OG1 THR A 46 11.798 6.653 -7.297 1.00 0.00 O ATOM 167 CG2 THR A 46 13.553 5.066 -7.223 1.00 0.00 C ATOM 0 H THR A 46 12.014 5.106 -5.053 1.00 0.00 H new ATOM 0 HA THR A 46 14.302 6.901 -5.105 1.00 0.00 H new ATOM 0 HB THR A 46 13.809 7.174 -7.343 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.776 7.333 -8.003 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.444 4.923 -8.298 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.594 4.912 -6.940 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.924 4.348 -6.696 1.00 0.00 H new ATOM 175 N PRO A 47 13.142 9.222 -5.229 1.00 0.00 N ATOM 176 CA PRO A 47 12.520 10.520 -4.952 1.00 0.00 C ATOM 177 C PRO A 47 11.241 10.720 -5.756 1.00 0.00 C ATOM 178 O PRO A 47 10.258 11.264 -5.254 1.00 0.00 O ATOM 179 CB PRO A 47 13.588 11.539 -5.370 1.00 0.00 C ATOM 180 CG PRO A 47 14.533 10.784 -6.242 1.00 0.00 C ATOM 181 CD PRO A 47 14.511 9.368 -5.744 1.00 0.00 C ATOM 0 HA PRO A 47 12.223 10.615 -3.908 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.143 12.378 -5.906 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.100 11.952 -4.500 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.226 10.835 -7.287 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.538 11.203 -6.184 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.720 8.656 -6.542 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.255 9.202 -4.965 1.00 0.00 H new ATOM 189 N GLU A 48 11.259 10.269 -7.006 1.00 0.00 N ATOM 190 CA GLU A 48 10.096 10.390 -7.875 1.00 0.00 C ATOM 191 C GLU A 48 8.947 9.538 -7.349 1.00 0.00 C ATOM 192 O GLU A 48 7.804 9.990 -7.280 1.00 0.00 O ATOM 193 CB GLU A 48 10.450 9.967 -9.302 1.00 0.00 C ATOM 194 CG GLU A 48 9.343 10.231 -10.309 1.00 0.00 C ATOM 195 CD GLU A 48 9.487 11.575 -10.996 1.00 0.00 C ATOM 196 OE1 GLU A 48 10.393 11.714 -11.844 1.00 0.00 O ATOM 197 OE2 GLU A 48 8.693 12.489 -10.685 1.00 0.00 O ATOM 0 H GLU A 48 12.065 9.817 -7.438 1.00 0.00 H new ATOM 0 HA GLU A 48 9.783 11.434 -7.885 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.349 10.497 -9.616 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.688 8.903 -9.308 1.00 0.00 H new ATOM 0 HG2 GLU A 48 9.345 9.441 -11.060 1.00 0.00 H new ATOM 0 HG3 GLU A 48 8.379 10.187 -9.803 1.00 0.00 H new ATOM 204 N GLU A 49 9.262 8.303 -6.970 1.00 0.00 N ATOM 205 CA GLU A 49 8.260 7.388 -6.441 1.00 0.00 C ATOM 206 C GLU A 49 7.736 7.882 -5.098 1.00 0.00 C ATOM 207 O GLU A 49 6.552 7.747 -4.792 1.00 0.00 O ATOM 208 CB GLU A 49 8.846 5.984 -6.291 1.00 0.00 C ATOM 209 CG GLU A 49 9.183 5.320 -7.616 1.00 0.00 C ATOM 210 CD GLU A 49 10.133 4.150 -7.459 1.00 0.00 C ATOM 211 OE1 GLU A 49 10.949 4.172 -6.513 1.00 0.00 O ATOM 212 OE2 GLU A 49 10.062 3.212 -8.280 1.00 0.00 O ATOM 0 H GLU A 49 10.204 7.914 -7.020 1.00 0.00 H new ATOM 0 HA GLU A 49 7.429 7.349 -7.145 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.748 6.039 -5.682 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.135 5.358 -5.751 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.264 4.975 -8.089 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.628 6.057 -8.284 1.00 0.00 H new ATOM 219 N ARG A 50 8.628 8.462 -4.302 1.00 0.00 N ATOM 220 CA ARG A 50 8.256 8.985 -2.993 1.00 0.00 C ATOM 221 C ARG A 50 7.372 10.219 -3.142 1.00 0.00 C ATOM 222 O ARG A 50 6.521 10.493 -2.295 1.00 0.00 O ATOM 223 CB ARG A 50 9.509 9.330 -2.184 1.00 0.00 C ATOM 224 CG ARG A 50 9.807 8.342 -1.066 1.00 0.00 C ATOM 225 CD ARG A 50 10.750 8.938 -0.031 1.00 0.00 C ATOM 226 NE ARG A 50 12.114 8.427 -0.172 1.00 0.00 N ATOM 227 CZ ARG A 50 13.205 9.193 -0.181 1.00 0.00 C ATOM 228 NH1 ARG A 50 13.109 10.510 -0.040 1.00 0.00 N ATOM 229 NH2 ARG A 50 14.399 8.636 -0.325 1.00 0.00 N ATOM 0 H ARG A 50 9.613 8.582 -4.540 1.00 0.00 H new ATOM 0 HA ARG A 50 7.694 8.217 -2.462 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.365 9.372 -2.857 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.391 10.325 -1.755 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.876 8.046 -0.583 1.00 0.00 H new ATOM 0 HG3 ARG A 50 10.250 7.439 -1.486 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.758 10.023 -0.130 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.380 8.712 0.969 1.00 0.00 H new ATOM 0 HE ARG A 50 12.238 7.419 -0.270 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.194 10.945 0.077 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.950 11.086 -0.048 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.481 7.625 -0.428 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.236 9.219 -0.332 1.00 0.00 H new ATOM 243 N SER A 51 7.581 10.960 -4.227 1.00 0.00 N ATOM 244 CA SER A 51 6.805 12.166 -4.491 1.00 0.00 C ATOM 245 C SER A 51 5.379 11.822 -4.905 1.00 0.00 C ATOM 246 O SER A 51 4.418 12.388 -4.387 1.00 0.00 O ATOM 247 CB SER A 51 7.480 13.001 -5.582 1.00 0.00 C ATOM 248 OG SER A 51 7.497 14.375 -5.236 1.00 0.00 O ATOM 0 H SER A 51 8.281 10.746 -4.937 1.00 0.00 H new ATOM 0 HA SER A 51 6.762 12.748 -3.570 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.500 12.649 -5.735 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.952 12.867 -6.526 1.00 0.00 H new ATOM 0 HG SER A 51 7.935 14.886 -5.948 1.00 0.00 H new ATOM 254 N ALA A 52 5.249 10.887 -5.835 1.00 0.00 N ATOM 255 CA ALA A 52 3.937 10.471 -6.310 1.00 0.00 C ATOM 256 C ALA A 52 3.136 9.844 -5.181 1.00 0.00 C ATOM 257 O ALA A 52 1.960 10.150 -4.994 1.00 0.00 O ATOM 258 CB ALA A 52 4.069 9.501 -7.468 1.00 0.00 C ATOM 0 H ALA A 52 6.032 10.404 -6.274 1.00 0.00 H new ATOM 0 HA ALA A 52 3.405 11.355 -6.662 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.077 9.203 -7.808 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.603 9.983 -8.287 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.621 8.619 -7.143 1.00 0.00 H new ATOM 264 N VAL A 53 3.789 8.977 -4.421 1.00 0.00 N ATOM 265 CA VAL A 53 3.149 8.319 -3.295 1.00 0.00 C ATOM 266 C VAL A 53 2.621 9.358 -2.323 1.00 0.00 C ATOM 267 O VAL A 53 1.425 9.414 -2.045 1.00 0.00 O ATOM 268 CB VAL A 53 4.131 7.380 -2.566 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.501 6.808 -1.302 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.583 6.264 -3.492 1.00 0.00 C ATOM 0 H VAL A 53 4.764 8.713 -4.565 1.00 0.00 H new ATOM 0 HA VAL A 53 2.323 7.720 -3.678 1.00 0.00 H new ATOM 0 HB VAL A 53 5.005 7.962 -2.272 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.214 6.149 -0.806 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.231 7.622 -0.629 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.607 6.243 -1.565 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.276 5.610 -2.962 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.717 5.688 -3.817 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.081 6.692 -4.362 1.00 0.00 H new ATOM 280 N GLU A 54 3.522 10.196 -1.828 1.00 0.00 N ATOM 281 CA GLU A 54 3.145 11.253 -0.896 1.00 0.00 C ATOM 282 C GLU A 54 2.010 12.090 -1.482 1.00 0.00 C ATOM 283 O GLU A 54 1.162 12.606 -0.754 1.00 0.00 O ATOM 284 CB GLU A 54 4.359 12.130 -0.550 1.00 0.00 C ATOM 285 CG GLU A 54 4.590 13.301 -1.496 1.00 0.00 C ATOM 286 CD GLU A 54 4.150 14.624 -0.903 1.00 0.00 C ATOM 287 OE1 GLU A 54 3.738 15.515 -1.676 1.00 0.00 O ATOM 288 OE2 GLU A 54 4.217 14.771 0.336 1.00 0.00 O ATOM 0 H GLU A 54 4.516 10.166 -2.055 1.00 0.00 H new ATOM 0 HA GLU A 54 2.791 10.796 0.028 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.234 12.517 0.461 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.252 11.504 -0.544 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.649 13.355 -1.750 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.048 13.125 -2.425 1.00 0.00 H new ATOM 295 N ASN A 55 1.994 12.199 -2.809 1.00 0.00 N ATOM 296 CA ASN A 55 0.957 12.947 -3.505 1.00 0.00 C ATOM 297 C ASN A 55 -0.347 12.157 -3.509 1.00 0.00 C ATOM 298 O ASN A 55 -1.437 12.726 -3.449 1.00 0.00 O ATOM 299 CB ASN A 55 1.390 13.239 -4.945 1.00 0.00 C ATOM 300 CG ASN A 55 2.514 14.252 -5.018 1.00 0.00 C ATOM 301 OD1 ASN A 55 2.599 15.164 -4.195 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.385 14.096 -6.007 1.00 0.00 N ATOM 0 H ASN A 55 2.691 11.776 -3.422 1.00 0.00 H new ATOM 0 HA ASN A 55 0.800 13.891 -2.984 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.710 12.312 -5.420 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.535 13.609 -5.510 1.00 0.00 H new ATOM 0 HD21 ASN A 55 4.164 14.747 -6.108 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.275 13.325 -6.666 1.00 0.00 H new ATOM 309 N TYR A 56 -0.214 10.837 -3.578 1.00 0.00 N ATOM 310 CA TYR A 56 -1.360 9.942 -3.591 1.00 0.00 C ATOM 311 C TYR A 56 -2.000 9.864 -2.203 1.00 0.00 C ATOM 312 O TYR A 56 -3.221 9.943 -2.068 1.00 0.00 O ATOM 313 CB TYR A 56 -0.912 8.555 -4.073 1.00 0.00 C ATOM 314 CG TYR A 56 -1.820 7.423 -3.660 1.00 0.00 C ATOM 315 CD1 TYR A 56 -3.135 7.366 -4.101 1.00 0.00 C ATOM 316 CD2 TYR A 56 -1.363 6.414 -2.825 1.00 0.00 C ATOM 317 CE1 TYR A 56 -3.969 6.335 -3.720 1.00 0.00 C ATOM 318 CE2 TYR A 56 -2.187 5.379 -2.441 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.489 5.343 -2.890 1.00 0.00 C ATOM 320 OH TYR A 56 -4.318 4.316 -2.503 1.00 0.00 O ATOM 0 H TYR A 56 0.687 10.361 -3.626 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.114 10.328 -4.277 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.841 8.568 -5.161 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.090 8.358 -3.691 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.511 8.141 -4.753 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -0.343 6.440 -2.470 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -4.991 6.305 -4.069 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -1.815 4.600 -1.792 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.403 4.315 -1.527 1.00 0.00 H new ATOM 330 N LEU A 57 -1.167 9.719 -1.175 1.00 0.00 N ATOM 331 CA LEU A 57 -1.657 9.640 0.199 1.00 0.00 C ATOM 332 C LEU A 57 -2.214 10.989 0.648 1.00 0.00 C ATOM 333 O LEU A 57 -3.213 11.053 1.364 1.00 0.00 O ATOM 334 CB LEU A 57 -0.531 9.214 1.147 1.00 0.00 C ATOM 335 CG LEU A 57 0.436 8.165 0.591 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.403 7.702 1.671 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.332 6.984 0.021 1.00 0.00 C ATOM 0 H LEU A 57 -0.153 9.654 -1.267 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.453 8.896 0.230 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.041 10.099 1.425 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.978 8.823 2.061 1.00 0.00 H new ATOM 0 HG LEU A 57 1.014 8.622 -0.213 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.082 6.957 1.256 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.978 8.554 2.034 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.843 7.263 2.497 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.370 6.248 -0.370 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.935 6.529 0.807 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.983 7.327 -0.783 1.00 0.00 H new ATOM 349 N GLU A 58 -1.556 12.063 0.225 1.00 0.00 N ATOM 350 CA GLU A 58 -1.980 13.414 0.584 1.00 0.00 C ATOM 351 C GLU A 58 -3.338 13.733 -0.025 1.00 0.00 C ATOM 352 O GLU A 58 -4.246 14.198 0.665 1.00 0.00 O ATOM 353 CB GLU A 58 -0.947 14.442 0.117 1.00 0.00 C ATOM 354 CG GLU A 58 0.149 14.711 1.135 1.00 0.00 C ATOM 355 CD GLU A 58 0.570 16.167 1.166 1.00 0.00 C ATOM 356 OE1 GLU A 58 1.780 16.439 1.015 1.00 0.00 O ATOM 357 OE2 GLU A 58 -0.309 17.037 1.340 1.00 0.00 O ATOM 0 H GLU A 58 -0.726 12.026 -0.367 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.063 13.464 1.670 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.492 14.092 -0.810 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.456 15.378 -0.112 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.199 14.416 2.125 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.015 14.091 0.904 1.00 0.00 H new ATOM 364 N SER A 59 -3.471 13.470 -1.317 1.00 0.00 N ATOM 365 CA SER A 59 -4.722 13.718 -2.020 1.00 0.00 C ATOM 366 C SER A 59 -5.799 12.756 -1.533 1.00 0.00 C ATOM 367 O SER A 59 -6.989 13.069 -1.556 1.00 0.00 O ATOM 368 CB SER A 59 -4.525 13.564 -3.530 1.00 0.00 C ATOM 369 OG SER A 59 -4.086 14.779 -4.113 1.00 0.00 O ATOM 0 H SER A 59 -2.728 13.085 -1.900 1.00 0.00 H new ATOM 0 HA SER A 59 -5.040 14.739 -1.811 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.796 12.778 -3.727 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.462 13.253 -3.992 1.00 0.00 H new ATOM 0 HG SER A 59 -3.966 14.654 -5.078 1.00 0.00 H new ATOM 375 N LEU A 60 -5.363 11.581 -1.089 1.00 0.00 N ATOM 376 CA LEU A 60 -6.270 10.558 -0.587 1.00 0.00 C ATOM 377 C LEU A 60 -7.137 11.097 0.545 1.00 0.00 C ATOM 378 O LEU A 60 -8.358 10.940 0.539 1.00 0.00 O ATOM 379 CB LEU A 60 -5.464 9.352 -0.103 1.00 0.00 C ATOM 380 CG LEU A 60 -5.286 8.241 -1.132 1.00 0.00 C ATOM 381 CD1 LEU A 60 -4.119 7.347 -0.747 1.00 0.00 C ATOM 382 CD2 LEU A 60 -6.565 7.429 -1.268 1.00 0.00 C ATOM 0 H LEU A 60 -4.379 11.314 -1.067 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.930 10.254 -1.399 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.479 9.695 0.213 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.954 8.936 0.777 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.067 8.695 -2.099 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.004 6.558 -1.491 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -3.206 7.940 -0.703 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.309 6.900 0.229 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -6.419 6.641 -2.007 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.817 6.983 -0.306 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -7.377 8.081 -1.589 1.00 0.00 H new ATOM 394 N THR A 61 -6.494 11.730 1.515 1.00 0.00 N ATOM 395 CA THR A 61 -7.197 12.295 2.662 1.00 0.00 C ATOM 396 C THR A 61 -8.003 13.526 2.259 1.00 0.00 C ATOM 397 O THR A 61 -9.022 13.840 2.873 1.00 0.00 O ATOM 398 CB THR A 61 -6.205 12.661 3.766 1.00 0.00 C ATOM 399 OG1 THR A 61 -5.344 13.703 3.341 1.00 0.00 O ATOM 400 CG2 THR A 61 -5.339 11.500 4.203 1.00 0.00 C ATOM 0 H THR A 61 -5.483 11.867 1.532 1.00 0.00 H new ATOM 0 HA THR A 61 -7.887 11.540 3.038 1.00 0.00 H new ATOM 0 HB THR A 61 -6.817 12.974 4.612 1.00 0.00 H new ATOM 0 HG1 THR A 61 -5.215 13.645 2.371 1.00 0.00 H new ATOM 0 HG21 THR A 61 -4.658 11.829 4.988 1.00 0.00 H new ATOM 0 HG22 THR A 61 -5.971 10.698 4.583 1.00 0.00 H new ATOM 0 HG23 THR A 61 -4.763 11.136 3.353 1.00 0.00 H new ATOM 408 N GLN A 62 -7.540 14.221 1.224 1.00 0.00 N ATOM 409 CA GLN A 62 -8.220 15.419 0.744 1.00 0.00 C ATOM 410 C GLN A 62 -9.470 15.056 -0.052 1.00 0.00 C ATOM 411 O GLN A 62 -10.476 15.762 -0.003 1.00 0.00 O ATOM 412 CB GLN A 62 -7.277 16.256 -0.120 1.00 0.00 C ATOM 413 CG GLN A 62 -7.889 17.565 -0.594 1.00 0.00 C ATOM 414 CD GLN A 62 -7.885 17.699 -2.104 1.00 0.00 C ATOM 415 OE1 GLN A 62 -7.509 18.738 -2.646 1.00 0.00 O ATOM 416 NE2 GLN A 62 -8.304 16.644 -2.794 1.00 0.00 N ATOM 0 H GLN A 62 -6.698 13.976 0.703 1.00 0.00 H new ATOM 0 HA GLN A 62 -8.522 16.005 1.612 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -6.372 16.472 0.448 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -6.976 15.670 -0.988 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -8.914 17.635 -0.230 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.338 18.398 -0.158 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -8.607 15.802 -2.304 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -8.323 16.676 -3.813 1.00 0.00 H new ATOM 425 N VAL A 63 -9.397 13.951 -0.785 1.00 0.00 N ATOM 426 CA VAL A 63 -10.523 13.494 -1.593 1.00 0.00 C ATOM 427 C VAL A 63 -11.585 12.826 -0.725 1.00 0.00 C ATOM 428 O VAL A 63 -11.330 11.801 -0.094 1.00 0.00 O ATOM 429 CB VAL A 63 -10.070 12.506 -2.686 1.00 0.00 C ATOM 430 CG1 VAL A 63 -11.235 12.142 -3.594 1.00 0.00 C ATOM 431 CG2 VAL A 63 -8.918 13.090 -3.491 1.00 0.00 C ATOM 0 H VAL A 63 -8.571 13.355 -0.837 1.00 0.00 H new ATOM 0 HA VAL A 63 -10.949 14.377 -2.070 1.00 0.00 H new ATOM 0 HB VAL A 63 -9.719 11.595 -2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -10.896 11.444 -4.359 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -12.025 11.678 -3.004 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -11.620 13.043 -4.071 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -8.612 12.378 -4.258 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -9.239 14.018 -3.965 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -8.077 13.293 -2.828 1.00 0.00 H new ATOM 441 N LEU A 64 -12.777 13.415 -0.698 1.00 0.00 N ATOM 442 CA LEU A 64 -13.879 12.877 0.092 1.00 0.00 C ATOM 443 C LEU A 64 -15.192 12.952 -0.683 1.00 0.00 C ATOM 444 O LEU A 64 -15.398 13.862 -1.485 1.00 0.00 O ATOM 445 CB LEU A 64 -14.008 13.642 1.411 1.00 0.00 C ATOM 446 CG LEU A 64 -12.691 13.897 2.146 1.00 0.00 C ATOM 447 CD1 LEU A 64 -12.781 15.166 2.979 1.00 0.00 C ATOM 448 CD2 LEU A 64 -12.331 12.706 3.022 1.00 0.00 C ATOM 0 H LEU A 64 -13.004 14.265 -1.214 1.00 0.00 H new ATOM 0 HA LEU A 64 -13.663 11.830 0.306 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -14.486 14.601 1.211 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -14.673 13.086 2.072 1.00 0.00 H new ATOM 0 HG LEU A 64 -11.903 14.029 1.405 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -11.835 15.331 3.494 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -12.992 16.014 2.328 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -13.581 15.064 3.713 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -11.391 12.904 3.538 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -13.120 12.542 3.756 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -12.223 11.817 2.401 1.00 0.00 H new ATOM 460 N GLN A 65 -16.075 11.990 -0.435 1.00 0.00 N ATOM 461 CA GLN A 65 -17.369 11.949 -1.109 1.00 0.00 C ATOM 462 C GLN A 65 -18.400 11.199 -0.272 1.00 0.00 C ATOM 463 O GLN A 65 -19.385 11.781 0.182 1.00 0.00 O ATOM 464 CB GLN A 65 -17.240 11.299 -2.493 1.00 0.00 C ATOM 465 CG GLN A 65 -16.254 10.140 -2.549 1.00 0.00 C ATOM 466 CD GLN A 65 -15.575 10.018 -3.899 1.00 0.00 C ATOM 467 OE1 GLN A 65 -16.237 9.929 -4.933 1.00 0.00 O ATOM 468 NE2 GLN A 65 -14.247 10.012 -3.895 1.00 0.00 N ATOM 0 H GLN A 65 -15.919 11.229 0.226 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.710 12.977 -1.235 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -18.221 10.942 -2.807 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -16.932 12.059 -3.211 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -15.497 10.274 -1.776 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.778 9.211 -2.324 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -13.739 10.088 -3.014 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -13.735 9.931 -4.773 1.00 0.00 H new ATOM 477 N VAL A 66 -18.161 9.906 -0.073 1.00 0.00 N ATOM 478 CA VAL A 66 -19.059 9.054 0.710 1.00 0.00 C ATOM 479 C VAL A 66 -20.529 9.366 0.432 1.00 0.00 C ATOM 480 O VAL A 66 -21.116 10.241 1.068 1.00 0.00 O ATOM 481 CB VAL A 66 -18.795 9.189 2.225 1.00 0.00 C ATOM 482 CG1 VAL A 66 -17.554 8.405 2.623 1.00 0.00 C ATOM 483 CG2 VAL A 66 -18.660 10.651 2.624 1.00 0.00 C ATOM 0 H VAL A 66 -17.346 9.419 -0.446 1.00 0.00 H new ATOM 0 HA VAL A 66 -18.851 8.030 0.399 1.00 0.00 H new ATOM 0 HB VAL A 66 -19.650 8.772 2.758 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -17.384 8.512 3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -17.696 7.352 2.382 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -16.691 8.789 2.079 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -18.474 10.720 3.696 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -17.828 11.101 2.082 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -19.581 11.181 2.380 1.00 0.00 H new ATOM 493 N PRO A 67 -21.147 8.650 -0.524 1.00 0.00 N ATOM 494 CA PRO A 67 -22.556 8.858 -0.878 1.00 0.00 C ATOM 495 C PRO A 67 -23.470 8.835 0.345 1.00 0.00 C ATOM 496 O PRO A 67 -24.542 9.440 0.342 1.00 0.00 O ATOM 497 CB PRO A 67 -22.869 7.679 -1.800 1.00 0.00 C ATOM 498 CG PRO A 67 -21.555 7.304 -2.394 1.00 0.00 C ATOM 499 CD PRO A 67 -20.526 7.583 -1.333 1.00 0.00 C ATOM 0 HA PRO A 67 -22.721 9.832 -1.339 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -23.305 6.848 -1.246 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.587 7.959 -2.571 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -21.543 6.253 -2.683 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -21.354 7.884 -3.295 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -20.316 6.696 -0.735 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -19.580 7.907 -1.767 1.00 0.00 H new ATOM 507 N GLY A 68 -23.038 8.133 1.387 1.00 0.00 N ATOM 508 CA GLY A 68 -23.827 8.045 2.601 1.00 0.00 C ATOM 509 C GLY A 68 -22.972 7.816 3.834 1.00 0.00 C ATOM 510 O GLY A 68 -22.787 6.675 4.260 1.00 0.00 O ATOM 0 H GLY A 68 -22.155 7.623 1.412 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -24.400 8.964 2.726 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -24.546 7.231 2.505 1.00 0.00 H new ATOM 514 N PRO A 69 -22.433 8.890 4.434 1.00 0.00 N ATOM 515 CA PRO A 69 -21.592 8.789 5.627 1.00 0.00 C ATOM 516 C PRO A 69 -22.410 8.631 6.905 1.00 0.00 C ATOM 517 O PRO A 69 -21.931 8.079 7.895 1.00 0.00 O ATOM 518 CB PRO A 69 -20.848 10.123 5.630 1.00 0.00 C ATOM 519 CG PRO A 69 -21.800 11.081 5.000 1.00 0.00 C ATOM 520 CD PRO A 69 -22.600 10.290 3.995 1.00 0.00 C ATOM 0 HA PRO A 69 -20.942 7.915 5.602 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -20.587 10.430 6.643 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -19.917 10.060 5.067 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -22.453 11.529 5.749 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -21.265 11.897 4.514 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -23.649 10.587 3.996 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -22.228 10.438 2.981 1.00 0.00 H new ATOM 528 N THR A 70 -23.646 9.119 6.874 1.00 0.00 N ATOM 529 CA THR A 70 -24.532 9.033 8.030 1.00 0.00 C ATOM 530 C THR A 70 -23.977 9.836 9.202 1.00 0.00 C ATOM 531 O THR A 70 -23.555 9.273 10.212 1.00 0.00 O ATOM 532 CB THR A 70 -24.730 7.572 8.444 1.00 0.00 C ATOM 533 OG1 THR A 70 -24.593 6.712 7.326 1.00 0.00 O ATOM 534 CG2 THR A 70 -26.083 7.304 9.067 1.00 0.00 C ATOM 0 H THR A 70 -24.057 9.578 6.061 1.00 0.00 H new ATOM 0 HA THR A 70 -25.496 9.455 7.748 1.00 0.00 H new ATOM 0 HB THR A 70 -23.960 7.376 9.190 1.00 0.00 H new ATOM 0 HG1 THR A 70 -24.721 5.783 7.610 1.00 0.00 H new ATOM 0 HG21 THR A 70 -26.157 6.251 9.337 1.00 0.00 H new ATOM 0 HG22 THR A 70 -26.200 7.917 9.961 1.00 0.00 H new ATOM 0 HG23 THR A 70 -26.868 7.551 8.352 1.00 0.00 H new ATOM 542 N GLY A 71 -23.981 11.158 9.060 1.00 0.00 N ATOM 543 CA GLY A 71 -23.476 12.019 10.113 1.00 0.00 C ATOM 544 C GLY A 71 -21.968 11.950 10.247 1.00 0.00 C ATOM 545 O GLY A 71 -21.239 12.519 9.434 1.00 0.00 O ATOM 0 H GLY A 71 -24.325 11.648 8.234 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -23.773 13.048 9.910 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -23.935 11.736 11.060 1.00 0.00 H new ATOM 549 N ALA A 72 -21.498 11.251 11.275 1.00 0.00 N ATOM 550 CA ALA A 72 -20.067 11.109 11.513 1.00 0.00 C ATOM 551 C ALA A 72 -19.758 9.795 12.224 1.00 0.00 C ATOM 552 O ALA A 72 -19.399 9.784 13.403 1.00 0.00 O ATOM 553 CB ALA A 72 -19.549 12.288 12.324 1.00 0.00 C ATOM 0 H ALA A 72 -22.088 10.774 11.957 1.00 0.00 H new ATOM 0 HA ALA A 72 -19.560 11.096 10.548 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -18.479 12.170 12.495 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -19.729 13.213 11.777 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -20.067 12.326 13.282 1.00 0.00 H new ATOM 559 N SER A 73 -19.899 8.689 11.502 1.00 0.00 N ATOM 560 CA SER A 73 -19.634 7.369 12.063 1.00 0.00 C ATOM 561 C SER A 73 -18.343 6.788 11.500 1.00 0.00 C ATOM 562 O SER A 73 -18.022 6.981 10.327 1.00 0.00 O ATOM 563 CB SER A 73 -20.803 6.426 11.771 1.00 0.00 C ATOM 564 OG SER A 73 -21.745 6.436 12.830 1.00 0.00 O ATOM 0 H SER A 73 -20.196 8.680 10.526 1.00 0.00 H new ATOM 0 HA SER A 73 -19.522 7.475 13.142 1.00 0.00 H new ATOM 0 HB2 SER A 73 -21.291 6.724 10.843 1.00 0.00 H new ATOM 0 HB3 SER A 73 -20.429 5.413 11.623 1.00 0.00 H new ATOM 0 HG SER A 73 -22.483 5.827 12.618 1.00 0.00 H new ATOM 570 N ALA A 74 -17.604 6.074 12.344 1.00 0.00 N ATOM 571 CA ALA A 74 -16.345 5.463 11.932 1.00 0.00 C ATOM 572 C ALA A 74 -15.322 6.523 11.541 1.00 0.00 C ATOM 573 O ALA A 74 -15.631 7.454 10.797 1.00 0.00 O ATOM 574 CB ALA A 74 -16.576 4.499 10.777 1.00 0.00 C ATOM 0 H ALA A 74 -17.856 5.904 13.318 1.00 0.00 H new ATOM 0 HA ALA A 74 -15.947 4.906 12.780 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -15.627 4.051 10.481 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -17.265 3.715 11.090 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -17.001 5.040 9.931 1.00 0.00 H new ATOM 580 N ALA A 75 -14.103 6.377 12.047 1.00 0.00 N ATOM 581 CA ALA A 75 -13.033 7.322 11.750 1.00 0.00 C ATOM 582 C ALA A 75 -12.324 6.959 10.447 1.00 0.00 C ATOM 583 O ALA A 75 -12.255 5.788 10.075 1.00 0.00 O ATOM 584 CB ALA A 75 -12.039 7.371 12.901 1.00 0.00 C ATOM 0 H ALA A 75 -13.831 5.613 12.665 1.00 0.00 H new ATOM 0 HA ALA A 75 -13.477 8.310 11.626 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -11.245 8.080 12.666 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -12.551 7.687 13.810 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.608 6.381 13.052 1.00 0.00 H new ATOM 590 N PRO A 76 -11.784 7.963 9.736 1.00 0.00 N ATOM 591 CA PRO A 76 -11.077 7.743 8.470 1.00 0.00 C ATOM 592 C PRO A 76 -9.776 6.971 8.666 1.00 0.00 C ATOM 593 O PRO A 76 -9.415 6.622 9.791 1.00 0.00 O ATOM 594 CB PRO A 76 -10.789 9.160 7.966 1.00 0.00 C ATOM 595 CG PRO A 76 -10.806 10.011 9.188 1.00 0.00 C ATOM 596 CD PRO A 76 -11.819 9.389 10.108 1.00 0.00 C ATOM 0 HA PRO A 76 -11.664 7.145 7.774 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -9.824 9.212 7.462 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -11.542 9.485 7.248 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -9.822 10.043 9.655 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.078 11.038 8.945 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -11.556 9.538 11.155 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -12.811 9.818 9.964 1.00 0.00 H new ATOM 604 N ILE A 77 -9.075 6.706 7.569 1.00 0.00 N ATOM 605 CA ILE A 77 -7.816 5.973 7.631 1.00 0.00 C ATOM 606 C ILE A 77 -6.793 6.539 6.651 1.00 0.00 C ATOM 607 O ILE A 77 -7.037 6.608 5.447 1.00 0.00 O ATOM 608 CB ILE A 77 -8.021 4.474 7.337 1.00 0.00 C ATOM 609 CG1 ILE A 77 -6.710 3.708 7.537 1.00 0.00 C ATOM 610 CG2 ILE A 77 -8.550 4.273 5.925 1.00 0.00 C ATOM 611 CD1 ILE A 77 -6.367 3.464 8.990 1.00 0.00 C ATOM 0 H ILE A 77 -9.356 6.987 6.629 1.00 0.00 H new ATOM 0 HA ILE A 77 -7.438 6.088 8.647 1.00 0.00 H new ATOM 0 HB ILE A 77 -8.760 4.082 8.036 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -6.777 2.750 7.022 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -5.898 4.265 7.069 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -8.688 3.208 5.736 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -9.505 4.788 5.818 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.836 4.679 5.208 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.426 2.917 9.055 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -6.268 4.419 9.506 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -7.160 2.880 9.458 1.00 0.00 H new ATOM 623 N SER A 78 -5.640 6.932 7.181 1.00 0.00 N ATOM 624 CA SER A 78 -4.563 7.483 6.369 1.00 0.00 C ATOM 625 C SER A 78 -3.226 7.293 7.075 1.00 0.00 C ATOM 626 O SER A 78 -3.105 7.558 8.271 1.00 0.00 O ATOM 627 CB SER A 78 -4.808 8.965 6.084 1.00 0.00 C ATOM 628 OG SER A 78 -4.389 9.772 7.171 1.00 0.00 O ATOM 0 H SER A 78 -5.427 6.878 8.177 1.00 0.00 H new ATOM 0 HA SER A 78 -4.538 6.951 5.418 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.271 9.258 5.182 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.868 9.131 5.892 1.00 0.00 H new ATOM 0 HG SER A 78 -4.555 10.715 6.962 1.00 0.00 H new ATOM 634 N LEU A 79 -2.227 6.822 6.338 1.00 0.00 N ATOM 635 CA LEU A 79 -0.906 6.587 6.918 1.00 0.00 C ATOM 636 C LEU A 79 0.020 7.786 6.721 1.00 0.00 C ATOM 637 O LEU A 79 0.005 8.434 5.674 1.00 0.00 O ATOM 638 CB LEU A 79 -0.262 5.326 6.326 1.00 0.00 C ATOM 639 CG LEU A 79 -0.847 4.831 5.004 1.00 0.00 C ATOM 640 CD1 LEU A 79 -0.565 5.826 3.888 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.278 3.463 4.661 1.00 0.00 C ATOM 0 H LEU A 79 -2.303 6.596 5.346 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.049 6.441 7.989 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.801 5.519 6.180 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.342 4.523 7.059 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.928 4.741 5.112 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.989 5.456 2.955 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.015 6.787 4.135 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.512 5.949 3.773 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.701 3.119 3.717 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.806 3.532 4.569 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.530 2.756 5.451 1.00 0.00 H new ATOM 653 N ALA A 80 0.836 8.063 7.737 1.00 0.00 N ATOM 654 CA ALA A 80 1.786 9.169 7.689 1.00 0.00 C ATOM 655 C ALA A 80 3.175 8.654 7.330 1.00 0.00 C ATOM 656 O ALA A 80 3.647 7.676 7.906 1.00 0.00 O ATOM 657 CB ALA A 80 1.817 9.902 9.021 1.00 0.00 C ATOM 0 H ALA A 80 0.856 7.532 8.608 1.00 0.00 H new ATOM 0 HA ALA A 80 1.465 9.871 6.919 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.531 10.724 8.967 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.825 10.297 9.242 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.117 9.212 9.809 1.00 0.00 H new ATOM 663 N LEU A 81 3.819 9.303 6.367 1.00 0.00 N ATOM 664 CA LEU A 81 5.143 8.884 5.919 1.00 0.00 C ATOM 665 C LEU A 81 6.192 9.042 7.015 1.00 0.00 C ATOM 666 O LEU A 81 6.230 10.047 7.724 1.00 0.00 O ATOM 667 CB LEU A 81 5.559 9.683 4.682 1.00 0.00 C ATOM 668 CG LEU A 81 5.263 9.004 3.343 1.00 0.00 C ATOM 669 CD1 LEU A 81 3.883 9.396 2.840 1.00 0.00 C ATOM 670 CD2 LEU A 81 6.328 9.360 2.317 1.00 0.00 C ATOM 0 H LEU A 81 3.447 10.120 5.882 1.00 0.00 H new ATOM 0 HA LEU A 81 5.082 7.825 5.667 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.051 10.647 4.703 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.629 9.885 4.741 1.00 0.00 H new ATOM 0 HG LEU A 81 5.279 7.925 3.493 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.690 8.904 1.887 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.130 9.089 3.566 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.838 10.477 2.706 1.00 0.00 H new ATOM 0 HD21 LEU A 81 6.101 8.868 1.371 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.345 10.440 2.170 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.303 9.027 2.674 1.00 0.00 H new ATOM 682 N ASN A 82 7.044 8.026 7.136 1.00 0.00 N ATOM 683 CA ASN A 82 8.112 8.013 8.130 1.00 0.00 C ATOM 684 C ASN A 82 9.445 7.684 7.471 1.00 0.00 C ATOM 685 O ASN A 82 9.516 7.498 6.256 1.00 0.00 O ATOM 686 CB ASN A 82 7.812 6.986 9.221 1.00 0.00 C ATOM 687 CG ASN A 82 6.931 7.542 10.320 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.471 8.682 10.249 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.693 6.734 11.346 1.00 0.00 N ATOM 0 H ASN A 82 7.013 7.192 6.550 1.00 0.00 H new ATOM 0 HA ASN A 82 8.172 9.004 8.581 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.325 6.119 8.774 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.750 6.637 9.654 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.107 7.050 12.119 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.096 5.797 11.361 1.00 0.00 H new ATOM 696 N ALA A 83 10.503 7.608 8.274 1.00 0.00 N ATOM 697 CA ALA A 83 11.828 7.295 7.753 1.00 0.00 C ATOM 698 C ALA A 83 11.815 5.990 6.964 1.00 0.00 C ATOM 699 O ALA A 83 12.570 5.830 6.005 1.00 0.00 O ATOM 700 CB ALA A 83 12.844 7.223 8.881 1.00 0.00 C ATOM 0 H ALA A 83 10.468 7.758 9.282 1.00 0.00 H new ATOM 0 HA ALA A 83 12.118 8.097 7.074 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.826 6.988 8.471 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.885 8.183 9.395 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.550 6.446 9.586 1.00 0.00 H new ATOM 706 N GLU A 84 10.945 5.062 7.360 1.00 0.00 N ATOM 707 CA GLU A 84 10.837 3.788 6.669 1.00 0.00 C ATOM 708 C GLU A 84 10.285 4.002 5.265 1.00 0.00 C ATOM 709 O GLU A 84 10.476 3.170 4.380 1.00 0.00 O ATOM 710 CB GLU A 84 9.939 2.828 7.453 1.00 0.00 C ATOM 711 CG GLU A 84 10.620 1.517 7.815 1.00 0.00 C ATOM 712 CD GLU A 84 10.026 0.329 7.082 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.355 0.543 6.051 1.00 0.00 O ATOM 714 OE2 GLU A 84 10.234 -0.813 7.540 1.00 0.00 O ATOM 0 H GLU A 84 10.311 5.172 8.151 1.00 0.00 H new ATOM 0 HA GLU A 84 11.830 3.345 6.594 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.606 3.320 8.367 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.048 2.614 6.863 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.683 1.588 7.583 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.538 1.354 8.890 1.00 0.00 H new ATOM 721 N SER A 85 9.611 5.138 5.068 1.00 0.00 N ATOM 722 CA SER A 85 9.036 5.483 3.772 1.00 0.00 C ATOM 723 C SER A 85 10.088 5.420 2.663 1.00 0.00 C ATOM 724 O SER A 85 9.749 5.378 1.479 1.00 0.00 O ATOM 725 CB SER A 85 8.421 6.883 3.823 1.00 0.00 C ATOM 726 OG SER A 85 9.422 7.883 3.750 1.00 0.00 O ATOM 0 H SER A 85 9.451 5.835 5.795 1.00 0.00 H new ATOM 0 HA SER A 85 8.258 4.753 3.547 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.719 7.006 2.998 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.852 7.000 4.745 1.00 0.00 H new ATOM 0 HG SER A 85 9.762 8.071 4.649 1.00 0.00 H new ATOM 732 N ASN A 86 11.362 5.410 3.048 1.00 0.00 N ATOM 733 CA ASN A 86 12.447 5.344 2.081 1.00 0.00 C ATOM 734 C ASN A 86 12.856 3.899 1.821 1.00 0.00 C ATOM 735 O ASN A 86 13.588 3.614 0.876 1.00 0.00 O ATOM 736 CB ASN A 86 13.653 6.137 2.575 1.00 0.00 C ATOM 737 CG ASN A 86 13.277 7.521 3.060 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.323 7.692 3.818 1.00 0.00 O ATOM 739 ND2 ASN A 86 14.031 8.518 2.619 1.00 0.00 N ATOM 0 H ASN A 86 11.665 5.447 4.021 1.00 0.00 H new ATOM 0 HA ASN A 86 12.090 5.781 1.148 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.136 5.590 3.385 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.382 6.223 1.769 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.830 9.476 2.907 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.812 8.328 1.991 1.00 0.00 H new ATOM 746 N ASN A 87 12.383 2.989 2.665 1.00 0.00 N ATOM 747 CA ASN A 87 12.703 1.578 2.515 1.00 0.00 C ATOM 748 C ASN A 87 11.456 0.786 2.154 1.00 0.00 C ATOM 749 O ASN A 87 10.590 0.555 2.999 1.00 0.00 O ATOM 750 CB ASN A 87 13.302 1.028 3.813 1.00 0.00 C ATOM 751 CG ASN A 87 14.209 2.023 4.510 1.00 0.00 C ATOM 752 OD1 ASN A 87 13.886 2.338 5.759 1.00 0.00 O flip ATOM 753 ND2 ASN A 87 15.187 2.502 3.934 1.00 0.00 N flip ATOM 0 H ASN A 87 11.778 3.204 3.458 1.00 0.00 H new ATOM 0 HA ASN A 87 13.433 1.477 1.712 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.495 0.744 4.488 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.866 0.122 3.592 1.00 0.00 H new ATOM 0 HD21 ASN A 87 15.397 2.231 2.973 1.00 0.00 H new ATOM 0 HD22 ASN A 87 15.787 3.170 4.418 1.00 0.00 H new ATOM 760 N VAL A 88 11.369 0.366 0.898 1.00 0.00 N ATOM 761 CA VAL A 88 10.221 -0.404 0.433 1.00 0.00 C ATOM 762 C VAL A 88 10.390 -1.887 0.742 1.00 0.00 C ATOM 763 O VAL A 88 11.494 -2.427 0.678 1.00 0.00 O ATOM 764 CB VAL A 88 9.993 -0.227 -1.080 1.00 0.00 C ATOM 765 CG1 VAL A 88 8.677 -0.868 -1.498 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.016 1.247 -1.457 1.00 0.00 C ATOM 0 H VAL A 88 12.076 0.544 0.185 1.00 0.00 H new ATOM 0 HA VAL A 88 9.351 -0.021 0.967 1.00 0.00 H new ATOM 0 HB VAL A 88 10.803 -0.727 -1.611 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.531 -0.734 -2.570 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.701 -1.933 -1.265 1.00 0.00 H new ATOM 0 HG13 VAL A 88 7.855 -0.397 -0.958 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.853 1.351 -2.530 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.228 1.773 -0.918 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.983 1.675 -1.194 1.00 0.00 H new ATOM 776 N MET A 89 9.281 -2.536 1.078 1.00 0.00 N ATOM 777 CA MET A 89 9.285 -3.959 1.402 1.00 0.00 C ATOM 778 C MET A 89 8.537 -4.755 0.335 1.00 0.00 C ATOM 779 O MET A 89 7.395 -4.441 0.006 1.00 0.00 O ATOM 780 CB MET A 89 8.642 -4.191 2.774 1.00 0.00 C ATOM 781 CG MET A 89 9.644 -4.502 3.873 1.00 0.00 C ATOM 782 SD MET A 89 10.556 -3.045 4.416 1.00 0.00 S ATOM 783 CE MET A 89 10.840 -3.444 6.138 1.00 0.00 C ATOM 0 H MET A 89 8.362 -2.097 1.133 1.00 0.00 H new ATOM 0 HA MET A 89 10.319 -4.302 1.431 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.073 -3.304 3.053 1.00 0.00 H new ATOM 0 HB3 MET A 89 7.932 -5.014 2.698 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.120 -4.936 4.725 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.348 -5.254 3.515 1.00 0.00 H new ATOM 0 HE1 MET A 89 11.582 -2.761 6.552 1.00 0.00 H new ATOM 0 HE2 MET A 89 9.907 -3.346 6.693 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.205 -4.468 6.219 1.00 0.00 H new ATOM 793 N MET A 90 9.189 -5.781 -0.201 1.00 0.00 N ATOM 794 CA MET A 90 8.584 -6.617 -1.235 1.00 0.00 C ATOM 795 C MET A 90 8.185 -7.977 -0.668 1.00 0.00 C ATOM 796 O MET A 90 8.993 -8.649 -0.029 1.00 0.00 O ATOM 797 CB MET A 90 9.551 -6.820 -2.411 1.00 0.00 C ATOM 798 CG MET A 90 10.592 -5.718 -2.574 1.00 0.00 C ATOM 799 SD MET A 90 10.093 -4.462 -3.766 1.00 0.00 S ATOM 800 CE MET A 90 10.939 -3.027 -3.112 1.00 0.00 C ATOM 0 H MET A 90 10.136 -6.055 0.062 1.00 0.00 H new ATOM 0 HA MET A 90 7.692 -6.103 -1.593 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.066 -7.772 -2.281 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.972 -6.894 -3.332 1.00 0.00 H new ATOM 0 HG2 MET A 90 10.770 -5.246 -1.608 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.536 -6.160 -2.892 1.00 0.00 H new ATOM 0 HE1 MET A 90 10.361 -2.130 -3.336 1.00 0.00 H new ATOM 0 HE2 MET A 90 11.047 -3.129 -2.032 1.00 0.00 H new ATOM 0 HE3 MET A 90 11.925 -2.946 -3.569 1.00 0.00 H new ATOM 810 N LEU A 91 6.939 -8.380 -0.905 1.00 0.00 N ATOM 811 CA LEU A 91 6.457 -9.667 -0.409 1.00 0.00 C ATOM 812 C LEU A 91 5.267 -10.175 -1.203 1.00 0.00 C ATOM 813 O LEU A 91 4.379 -9.409 -1.571 1.00 0.00 O ATOM 814 CB LEU A 91 6.041 -9.560 1.060 1.00 0.00 C ATOM 815 CG LEU A 91 4.877 -8.602 1.330 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.808 -9.283 2.173 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.371 -7.335 2.013 1.00 0.00 C ATOM 0 H LEU A 91 6.251 -7.841 -1.431 1.00 0.00 H new ATOM 0 HA LEU A 91 7.284 -10.369 -0.520 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.767 -10.552 1.419 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.902 -9.236 1.644 1.00 0.00 H new ATOM 0 HG LEU A 91 4.434 -8.324 0.374 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.989 -8.587 2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.430 -10.158 1.644 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.238 -9.593 3.125 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.528 -6.668 2.196 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.842 -7.593 2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.097 -6.835 1.372 1.00 0.00 H new ATOM 829 N THR A 92 5.224 -11.484 -1.405 1.00 0.00 N ATOM 830 CA THR A 92 4.102 -12.103 -2.087 1.00 0.00 C ATOM 831 C THR A 92 3.076 -12.460 -1.027 1.00 0.00 C ATOM 832 O THR A 92 3.342 -13.290 -0.157 1.00 0.00 O ATOM 833 CB THR A 92 4.546 -13.353 -2.850 1.00 0.00 C ATOM 834 OG1 THR A 92 3.427 -14.046 -3.373 1.00 0.00 O ATOM 835 CG2 THR A 92 5.331 -14.327 -1.997 1.00 0.00 C ATOM 0 H THR A 92 5.951 -12.134 -1.107 1.00 0.00 H new ATOM 0 HA THR A 92 3.678 -11.418 -2.821 1.00 0.00 H new ATOM 0 HB THR A 92 5.193 -12.989 -3.648 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.732 -14.841 -3.858 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.615 -15.190 -2.599 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.228 -13.838 -1.618 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.716 -14.655 -1.159 1.00 0.00 H new ATOM 843 N HIS A 93 1.931 -11.797 -1.055 1.00 0.00 N ATOM 844 CA HIS A 93 0.920 -12.029 -0.036 1.00 0.00 C ATOM 845 C HIS A 93 -0.468 -11.597 -0.499 1.00 0.00 C ATOM 846 O HIS A 93 -0.609 -10.682 -1.311 1.00 0.00 O ATOM 847 CB HIS A 93 1.324 -11.254 1.220 1.00 0.00 C ATOM 848 CG HIS A 93 1.179 -12.021 2.493 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.026 -12.507 2.951 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.102 -12.374 3.417 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.160 -13.125 4.103 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.444 -13.060 4.407 1.00 0.00 N ATOM 0 H HIS A 93 1.681 -11.104 -1.760 1.00 0.00 H new ATOM 0 HA HIS A 93 0.864 -13.098 0.171 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.362 -10.937 1.118 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.719 -10.350 1.284 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.159 -12.157 3.382 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.607 -13.602 4.696 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.876 -13.455 5.242 1.00 0.00 H new ATOM 861 N ALA A 94 -1.490 -12.260 0.033 1.00 0.00 N ATOM 862 CA ALA A 94 -2.871 -11.948 -0.309 1.00 0.00 C ATOM 863 C ALA A 94 -3.332 -10.685 0.406 1.00 0.00 C ATOM 864 O ALA A 94 -3.019 -10.476 1.578 1.00 0.00 O ATOM 865 CB ALA A 94 -3.779 -13.115 0.047 1.00 0.00 C ATOM 0 H ALA A 94 -1.386 -13.020 0.705 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.926 -11.774 -1.384 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.808 -12.868 -0.214 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.467 -14.001 -0.506 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.714 -13.314 1.117 1.00 0.00 H new ATOM 871 N ILE A 95 -4.076 -9.844 -0.302 1.00 0.00 N ATOM 872 CA ILE A 95 -4.574 -8.601 0.276 1.00 0.00 C ATOM 873 C ILE A 95 -6.048 -8.716 0.645 1.00 0.00 C ATOM 874 O ILE A 95 -6.877 -9.113 -0.174 1.00 0.00 O ATOM 875 CB ILE A 95 -4.394 -7.395 -0.677 1.00 0.00 C ATOM 876 CG1 ILE A 95 -3.409 -7.724 -1.803 1.00 0.00 C ATOM 877 CG2 ILE A 95 -3.924 -6.173 0.099 1.00 0.00 C ATOM 878 CD1 ILE A 95 -2.007 -8.020 -1.319 1.00 0.00 C ATOM 0 H ILE A 95 -4.347 -9.999 -1.273 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.980 -8.428 1.173 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.361 -7.174 -1.129 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.781 -8.585 -2.359 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -3.374 -6.886 -2.499 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.802 -5.333 -0.585 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.663 -5.918 0.859 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.970 -6.392 0.579 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.367 -8.244 -2.173 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.614 -7.152 -0.789 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.028 -8.877 -0.646 1.00 0.00 H new ATOM 890 N THR A 96 -6.368 -8.353 1.882 1.00 0.00 N ATOM 891 CA THR A 96 -7.743 -8.401 2.363 1.00 0.00 C ATOM 892 C THR A 96 -8.367 -7.012 2.296 1.00 0.00 C ATOM 893 O THR A 96 -7.661 -6.008 2.360 1.00 0.00 O ATOM 894 CB THR A 96 -7.792 -8.934 3.796 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.592 -9.615 4.120 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.940 -9.889 4.040 1.00 0.00 C ATOM 0 H THR A 96 -5.692 -8.022 2.571 1.00 0.00 H new ATOM 0 HA THR A 96 -8.312 -9.077 1.725 1.00 0.00 H new ATOM 0 HB THR A 96 -7.930 -8.055 4.426 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.908 -8.965 4.383 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.916 -10.229 5.075 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.884 -9.380 3.847 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.848 -10.747 3.374 1.00 0.00 H new ATOM 904 N ARG A 97 -9.686 -6.956 2.149 1.00 0.00 N ATOM 905 CA ARG A 97 -10.382 -5.675 2.059 1.00 0.00 C ATOM 906 C ARG A 97 -11.363 -5.484 3.210 1.00 0.00 C ATOM 907 O ARG A 97 -12.350 -6.210 3.329 1.00 0.00 O ATOM 908 CB ARG A 97 -11.121 -5.569 0.723 1.00 0.00 C ATOM 909 CG ARG A 97 -10.523 -4.537 -0.217 1.00 0.00 C ATOM 910 CD ARG A 97 -11.595 -3.670 -0.858 1.00 0.00 C ATOM 911 NE ARG A 97 -11.167 -2.278 -0.983 1.00 0.00 N ATOM 912 CZ ARG A 97 -11.661 -1.425 -1.877 1.00 0.00 C ATOM 913 NH1 ARG A 97 -12.625 -1.804 -2.707 1.00 0.00 N ATOM 914 NH2 ARG A 97 -11.192 -0.187 -1.938 1.00 0.00 N ATOM 0 H ARG A 97 -10.292 -7.774 2.090 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.632 -4.887 2.124 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -11.113 -6.543 0.234 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.164 -5.316 0.912 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.825 -3.905 0.333 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.951 -5.042 -0.995 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -11.839 -4.065 -1.844 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.506 -3.718 -0.261 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.446 -1.940 -0.346 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.992 -2.755 -2.662 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.999 -1.145 -3.390 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -10.454 0.111 -1.300 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -11.569 0.468 -2.623 1.00 0.00 H new ATOM 928 N TYR A 98 -11.088 -4.492 4.050 1.00 0.00 N ATOM 929 CA TYR A 98 -11.947 -4.189 5.187 1.00 0.00 C ATOM 930 C TYR A 98 -12.564 -2.799 5.042 1.00 0.00 C ATOM 931 O TYR A 98 -11.931 -1.793 5.361 1.00 0.00 O ATOM 932 CB TYR A 98 -11.147 -4.266 6.490 1.00 0.00 C ATOM 933 CG TYR A 98 -10.842 -5.680 6.931 1.00 0.00 C ATOM 934 CD1 TYR A 98 -11.585 -6.291 7.934 1.00 0.00 C ATOM 935 CD2 TYR A 98 -9.811 -6.404 6.345 1.00 0.00 C ATOM 936 CE1 TYR A 98 -11.310 -7.583 8.340 1.00 0.00 C ATOM 937 CE2 TYR A 98 -9.530 -7.696 6.745 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.281 -8.281 7.743 1.00 0.00 C ATOM 939 OH TYR A 98 -10.004 -9.567 8.145 1.00 0.00 O ATOM 0 H TYR A 98 -10.274 -3.883 3.964 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.749 -4.927 5.214 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.210 -3.724 6.364 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.704 -3.761 7.279 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.391 -5.747 8.404 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.220 -5.949 5.564 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -11.898 -8.044 9.120 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -8.726 -8.246 6.278 1.00 0.00 H new ATOM 0 HH TYR A 98 -9.251 -9.917 7.624 1.00 0.00 H new ATOM 949 N GLY A 99 -13.804 -2.751 4.560 1.00 0.00 N ATOM 950 CA GLY A 99 -14.482 -1.481 4.384 1.00 0.00 C ATOM 951 C GLY A 99 -14.948 -0.876 5.694 1.00 0.00 C ATOM 952 O GLY A 99 -15.458 -1.581 6.565 1.00 0.00 O ATOM 0 H GLY A 99 -14.349 -3.569 4.289 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.811 -0.782 3.885 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.341 -1.621 3.728 1.00 0.00 H new ATOM 956 N ILE A 100 -14.763 0.433 5.834 1.00 0.00 N ATOM 957 CA ILE A 100 -15.159 1.136 7.051 1.00 0.00 C ATOM 958 C ILE A 100 -15.539 2.593 6.776 1.00 0.00 C ATOM 959 O ILE A 100 -15.708 3.380 7.708 1.00 0.00 O ATOM 960 CB ILE A 100 -14.032 1.109 8.101 1.00 0.00 C ATOM 961 CG1 ILE A 100 -12.825 1.920 7.616 1.00 0.00 C ATOM 962 CG2 ILE A 100 -13.629 -0.326 8.408 1.00 0.00 C ATOM 963 CD1 ILE A 100 -12.199 1.385 6.345 1.00 0.00 C ATOM 0 H ILE A 100 -14.342 1.029 5.121 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.034 0.611 7.435 1.00 0.00 H new ATOM 0 HB ILE A 100 -14.402 1.566 9.019 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -13.135 2.952 7.451 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -12.070 1.936 8.402 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -12.832 -0.329 9.151 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -14.490 -0.870 8.797 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -13.276 -0.808 7.496 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -11.352 2.011 6.065 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -11.856 0.364 6.510 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -12.938 1.395 5.544 1.00 0.00 H new ATOM 975 N SER A 101 -15.669 2.952 5.503 1.00 0.00 N ATOM 976 CA SER A 101 -16.021 4.318 5.128 1.00 0.00 C ATOM 977 C SER A 101 -17.337 4.357 4.359 1.00 0.00 C ATOM 978 O SER A 101 -18.046 5.363 4.376 1.00 0.00 O ATOM 979 CB SER A 101 -14.911 4.933 4.275 1.00 0.00 C ATOM 980 OG SER A 101 -14.741 6.308 4.571 1.00 0.00 O ATOM 0 H SER A 101 -15.536 2.318 4.715 1.00 0.00 H new ATOM 0 HA SER A 101 -16.139 4.896 6.044 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.976 4.402 4.452 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.151 4.812 3.219 1.00 0.00 H new ATOM 0 HG SER A 101 -14.024 6.677 4.013 1.00 0.00 H new ATOM 986 N THR A 102 -17.651 3.261 3.680 1.00 0.00 N ATOM 987 CA THR A 102 -18.874 3.171 2.895 1.00 0.00 C ATOM 988 C THR A 102 -19.178 1.721 2.537 1.00 0.00 C ATOM 989 O THR A 102 -18.309 0.854 2.628 1.00 0.00 O ATOM 990 CB THR A 102 -18.737 4.005 1.621 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.355 5.334 1.929 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.011 4.073 0.806 1.00 0.00 C ATOM 0 H THR A 102 -17.074 2.420 3.658 1.00 0.00 H new ATOM 0 HA THR A 102 -19.699 3.560 3.493 1.00 0.00 H new ATOM 0 HB THR A 102 -17.973 3.500 1.030 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.652 5.558 2.835 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.842 4.680 -0.083 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.306 3.067 0.508 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.803 4.521 1.406 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.416 1.463 2.130 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.828 0.116 1.758 1.00 0.00 C ATOM 1002 C ASP A 103 -20.782 -0.074 0.245 1.00 0.00 C ATOM 1003 O ASP A 103 -21.484 -0.921 -0.307 1.00 0.00 O ATOM 1004 CB ASP A 103 -22.237 -0.168 2.272 1.00 0.00 C ATOM 1005 CG ASP A 103 -22.316 -0.145 3.786 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -22.829 -1.123 4.369 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -21.865 0.852 4.389 1.00 0.00 O ATOM 0 H ASP A 103 -21.149 2.167 2.050 1.00 0.00 H new ATOM 0 HA ASP A 103 -20.130 -0.586 2.215 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.926 0.572 1.864 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.564 -1.142 1.909 1.00 0.00 H new ATOM 1012 N ASP A 104 -19.948 0.717 -0.421 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.804 0.635 -1.869 1.00 0.00 C ATOM 1014 C ASP A 104 -18.330 0.689 -2.256 1.00 0.00 C ATOM 1015 O ASP A 104 -17.578 1.496 -1.713 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.572 1.771 -2.547 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.567 1.267 -3.573 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -21.649 1.867 -4.666 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.263 0.271 -3.284 1.00 0.00 O ATOM 0 H ASP A 104 -19.360 1.424 0.021 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.220 -0.314 -2.206 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.099 2.352 -1.790 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -19.865 2.445 -3.031 1.00 0.00 H new ATOM 1024 N PRO A 105 -17.897 -0.170 -3.203 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.507 -0.225 -3.664 1.00 0.00 C ATOM 1026 C PRO A 105 -15.819 1.135 -3.672 1.00 0.00 C ATOM 1027 O PRO A 105 -15.811 1.835 -4.684 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.665 -0.765 -5.078 1.00 0.00 C ATOM 1029 CG PRO A 105 -17.809 -1.714 -4.974 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.731 -1.161 -3.910 1.00 0.00 C ATOM 0 HA PRO A 105 -15.876 -0.829 -3.013 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -16.872 0.034 -5.790 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -15.759 -1.267 -5.417 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.328 -1.802 -5.929 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.462 -2.712 -4.706 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.616 -0.700 -4.348 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.080 -1.944 -3.236 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.248 1.501 -2.530 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.563 2.779 -2.399 1.00 0.00 C ATOM 1040 C ASN A 106 -13.445 2.716 -1.359 1.00 0.00 C ATOM 1041 O ASN A 106 -13.091 1.643 -0.872 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.562 3.878 -2.030 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.657 4.029 -3.067 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -17.902 3.862 -2.641 1.00 0.00 O flip ATOM 1045 ND2 ASN A 106 -16.386 4.295 -4.238 1.00 0.00 N flip ATOM 0 H ASN A 106 -15.246 0.931 -1.684 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.109 3.012 -3.362 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.009 3.650 -1.063 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.034 4.825 -1.922 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.414 4.415 -4.522 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.134 4.395 -4.924 1.00 0.00 H new ATOM 1052 N LYS A 107 -12.889 3.883 -1.038 1.00 0.00 N ATOM 1053 CA LYS A 107 -11.800 3.995 -0.068 1.00 0.00 C ATOM 1054 C LYS A 107 -12.058 3.149 1.176 1.00 0.00 C ATOM 1055 O LYS A 107 -12.960 3.437 1.963 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.600 5.470 0.311 1.00 0.00 C ATOM 1057 CG LYS A 107 -10.855 5.698 1.621 1.00 0.00 C ATOM 1058 CD LYS A 107 -11.530 6.771 2.462 1.00 0.00 C ATOM 1059 CE LYS A 107 -11.318 6.531 3.947 1.00 0.00 C ATOM 1060 NZ LYS A 107 -11.419 7.793 4.733 1.00 0.00 N ATOM 0 H LYS A 107 -13.179 4.774 -1.441 1.00 0.00 H new ATOM 0 HA LYS A 107 -10.890 3.612 -0.531 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.055 5.966 -0.492 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.577 5.949 0.377 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -10.812 4.766 2.184 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -9.827 5.991 1.411 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.134 7.750 2.191 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -12.598 6.787 2.244 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.058 5.818 4.309 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -10.338 6.082 4.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -10.547 7.930 5.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -11.549 8.596 4.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -12.231 7.735 5.380 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.247 2.110 1.339 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.353 1.204 2.475 1.00 0.00 C ATOM 1076 C TRP A 108 -9.970 0.778 2.955 1.00 0.00 C ATOM 1077 O TRP A 108 -8.954 1.167 2.379 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.175 -0.024 2.109 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.610 0.288 1.819 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.381 1.250 2.404 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.446 -0.376 0.876 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.645 1.226 1.872 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.712 0.231 0.935 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.242 -1.426 -0.013 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.773 -0.183 0.136 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.292 -1.837 -0.809 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.546 -1.217 -0.729 1.00 0.00 C ATOM 0 H TRP A 108 -10.499 1.873 0.688 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.857 1.735 3.282 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.731 -0.503 1.236 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.125 -0.743 2.927 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.045 1.930 3.173 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.410 1.848 2.132 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.279 -1.911 -0.079 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.740 0.295 0.197 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -15.145 -2.650 -1.505 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.349 -1.563 -1.363 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.937 -0.015 4.019 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.678 -0.487 4.586 1.00 0.00 C ATOM 1100 C ARG A 109 -8.361 -1.890 4.094 1.00 0.00 C ATOM 1101 O ARG A 109 -9.241 -2.744 4.029 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.774 -0.515 6.113 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.029 0.610 6.803 1.00 0.00 C ATOM 1104 CD ARG A 109 -8.777 1.098 8.034 1.00 0.00 C ATOM 1105 NE ARG A 109 -8.777 0.102 9.105 1.00 0.00 N ATOM 1106 CZ ARG A 109 -9.732 -0.812 9.276 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -10.790 -0.847 8.475 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -9.633 -1.690 10.264 1.00 0.00 N ATOM 0 H ARG A 109 -10.769 -0.346 4.508 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.887 0.194 4.271 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.824 -0.470 6.401 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.385 -1.468 6.473 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.035 0.267 7.091 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.891 1.438 6.107 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -8.319 2.019 8.395 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -9.805 1.338 7.762 1.00 0.00 H new ATOM 0 HE ARG A 109 -7.997 0.107 9.762 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -10.879 -0.169 7.718 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -11.514 -1.552 8.617 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -8.828 -1.665 10.890 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -10.362 -2.391 10.398 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.098 -2.131 3.762 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.683 -3.442 3.297 1.00 0.00 C ATOM 1124 C TYR A 110 -5.866 -4.131 4.373 1.00 0.00 C ATOM 1125 O TYR A 110 -5.428 -3.490 5.326 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.881 -3.329 2.004 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.741 -3.055 0.794 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.253 -1.786 0.557 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -7.037 -4.064 -0.116 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -8.036 -1.527 -0.553 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.820 -3.813 -1.227 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.316 -2.544 -1.441 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.093 -2.290 -2.547 1.00 0.00 O ATOM 0 H TYR A 110 -6.350 -1.438 3.807 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.571 -4.039 3.089 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.146 -2.531 2.108 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.326 -4.254 1.846 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -7.036 -0.988 1.251 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.649 -5.059 0.048 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.426 -0.534 -0.723 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.042 -4.607 -1.924 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.537 -2.330 -3.353 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.682 -5.437 4.243 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.929 -6.178 5.245 1.00 0.00 C ATOM 1145 C TYR A 111 -4.040 -7.246 4.629 1.00 0.00 C ATOM 1146 O TYR A 111 -4.499 -8.095 3.866 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.883 -6.819 6.250 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.340 -5.865 7.330 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -5.895 -6.012 8.637 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -7.209 -4.816 7.041 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.302 -5.139 9.629 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.619 -3.942 8.028 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.163 -4.107 9.320 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.568 -3.237 10.306 1.00 0.00 O ATOM 0 H TYR A 111 -6.037 -5.998 3.468 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.280 -5.464 5.752 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.755 -7.202 5.720 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.391 -7.674 6.714 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.221 -6.820 8.882 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.567 -4.684 6.031 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -5.947 -5.265 10.641 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.294 -3.133 7.790 1.00 0.00 H new ATOM 0 HH TYR A 111 -7.041 -2.412 10.251 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.769 -7.215 5.005 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.806 -8.195 4.534 1.00 0.00 C ATOM 1166 C LEU A 112 -1.443 -9.123 5.680 1.00 0.00 C ATOM 1167 O LEU A 112 -0.776 -8.717 6.632 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.554 -7.511 3.986 1.00 0.00 C ATOM 1169 CG LEU A 112 -0.010 -8.119 2.695 1.00 0.00 C ATOM 1170 CD1 LEU A 112 -1.091 -8.155 1.629 1.00 0.00 C ATOM 1171 CD2 LEU A 112 1.194 -7.339 2.203 1.00 0.00 C ATOM 0 H LEU A 112 -2.381 -6.516 5.639 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.251 -8.771 3.723 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.778 -6.459 3.810 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.226 -7.548 4.746 1.00 0.00 H new ATOM 0 HG LEU A 112 0.305 -9.141 2.903 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.687 -8.591 0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -1.928 -8.759 1.980 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -1.435 -7.141 1.426 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.567 -7.788 1.282 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.905 -6.306 2.012 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.977 -7.362 2.961 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.913 -10.361 5.607 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.657 -11.321 6.667 1.00 0.00 C ATOM 1185 C ASP A 113 -2.380 -10.863 7.942 1.00 0.00 C ATOM 1186 O ASP A 113 -3.583 -10.608 7.911 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.146 -11.469 6.893 1.00 0.00 C ATOM 1188 CG ASP A 113 0.208 -12.741 7.639 1.00 0.00 C ATOM 1189 OD1 ASP A 113 1.097 -13.480 7.165 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.403 -12.999 8.698 1.00 0.00 O ATOM 0 H ASP A 113 -2.469 -10.720 4.831 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.041 -12.302 6.385 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.364 -11.462 5.930 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.220 -10.609 7.454 1.00 0.00 H new ATOM 1195 N SER A 114 -1.657 -10.741 9.054 1.00 0.00 N ATOM 1196 CA SER A 114 -2.258 -10.294 10.303 1.00 0.00 C ATOM 1197 C SER A 114 -2.022 -8.799 10.520 1.00 0.00 C ATOM 1198 O SER A 114 -2.127 -8.308 11.644 1.00 0.00 O ATOM 1199 CB SER A 114 -1.687 -11.089 11.480 1.00 0.00 C ATOM 1200 OG SER A 114 -2.587 -12.102 11.894 1.00 0.00 O ATOM 0 H SER A 114 -0.659 -10.945 9.113 1.00 0.00 H new ATOM 0 HA SER A 114 -3.332 -10.467 10.242 1.00 0.00 H new ATOM 0 HB2 SER A 114 -0.736 -11.538 11.193 1.00 0.00 H new ATOM 0 HB3 SER A 114 -1.483 -10.416 12.313 1.00 0.00 H new ATOM 0 HG SER A 114 -2.199 -12.597 12.646 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.690 -8.077 9.448 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.428 -6.645 9.555 1.00 0.00 C ATOM 1208 C VAL A 115 -2.314 -5.833 8.615 1.00 0.00 C ATOM 1209 O VAL A 115 -2.773 -6.333 7.588 1.00 0.00 O ATOM 1210 CB VAL A 115 0.046 -6.322 9.249 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.355 -4.869 9.574 1.00 0.00 C ATOM 1212 CG2 VAL A 115 0.969 -7.257 10.017 1.00 0.00 C ATOM 0 H VAL A 115 -1.597 -8.458 8.506 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.656 -6.368 10.584 1.00 0.00 H new ATOM 0 HB VAL A 115 0.218 -6.475 8.183 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.401 -4.661 9.351 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.281 -4.219 8.973 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.166 -4.685 10.632 1.00 0.00 H new ATOM 0 HG21 VAL A 115 2.006 -7.013 9.788 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.797 -7.140 11.087 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.766 -8.288 9.727 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.539 -4.573 8.975 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.357 -3.676 8.167 1.00 0.00 C ATOM 1224 C GLU A 116 -2.485 -2.898 7.187 1.00 0.00 C ATOM 1225 O GLU A 116 -1.470 -2.319 7.573 1.00 0.00 O ATOM 1226 CB GLU A 116 -4.130 -2.707 9.066 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.239 -1.733 9.821 1.00 0.00 C ATOM 1228 CD GLU A 116 -3.813 -1.345 11.169 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -4.240 -0.181 11.321 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.834 -2.205 12.076 1.00 0.00 O ATOM 0 H GLU A 116 -2.165 -4.149 9.824 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.070 -4.275 7.601 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.835 -2.143 8.456 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.717 -3.280 9.784 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.256 -2.181 9.964 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.096 -0.836 9.219 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.880 -2.894 5.920 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.122 -2.192 4.892 1.00 0.00 C ATOM 1239 C VAL A 117 -3.016 -1.314 4.022 1.00 0.00 C ATOM 1240 O VAL A 117 -4.246 -1.446 4.020 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.355 -3.182 3.992 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.396 -4.024 4.819 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.323 -4.070 3.222 1.00 0.00 C ATOM 0 H VAL A 117 -3.718 -3.367 5.580 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.411 -1.552 5.416 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.772 -2.608 3.271 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.136 -4.716 4.166 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.321 -3.373 5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.957 -4.587 5.565 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.761 -4.761 2.593 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.936 -4.635 3.924 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.966 -3.451 2.596 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.375 -0.409 3.289 1.00 0.00 N ATOM 1254 CA HIS A 118 -3.079 0.515 2.409 1.00 0.00 C ATOM 1255 C HIS A 118 -2.903 0.131 0.942 1.00 0.00 C ATOM 1256 O HIS A 118 -1.855 0.379 0.345 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.557 1.933 2.634 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.301 2.989 1.873 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -4.154 3.883 2.478 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.308 3.302 0.552 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.654 4.695 1.566 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -4.162 4.362 0.388 1.00 0.00 N ATOM 0 H HIS A 118 -1.361 -0.296 3.288 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.142 0.467 2.646 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.609 2.163 3.698 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.505 1.970 2.351 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -4.367 3.913 3.475 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.745 2.808 -0.226 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.351 5.499 1.753 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.941 -0.461 0.365 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.919 -0.867 -1.036 1.00 0.00 C ATOM 1273 C LEU A 119 -4.830 0.043 -1.857 1.00 0.00 C ATOM 1274 O LEU A 119 -6.046 0.035 -1.672 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.374 -2.318 -1.173 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.168 -2.925 -2.553 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -3.886 -4.415 -2.451 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.382 -2.662 -3.420 1.00 0.00 C ATOM 0 H LEU A 119 -4.814 -0.672 0.848 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.899 -0.782 -1.410 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.837 -2.923 -0.442 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.433 -2.377 -0.920 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.301 -2.454 -3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.742 -4.827 -3.450 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -2.985 -4.575 -1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.729 -4.913 -1.971 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.227 -3.100 -4.406 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.262 -3.110 -2.959 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.532 -1.587 -3.520 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.261 0.858 -2.766 1.00 0.00 N ATOM 1291 CA PRO A 120 -5.046 1.778 -3.588 1.00 0.00 C ATOM 1292 C PRO A 120 -6.233 1.096 -4.266 1.00 0.00 C ATOM 1293 O PRO A 120 -6.129 -0.031 -4.745 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.049 2.305 -4.629 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.808 1.493 -4.462 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.826 0.961 -3.057 1.00 0.00 C ATOM 0 HA PRO A 120 -5.488 2.569 -2.983 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.449 2.203 -5.638 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.846 3.364 -4.472 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.779 0.677 -5.184 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.921 2.102 -4.634 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.328 -0.006 -2.984 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.320 1.633 -2.364 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.389 1.780 -4.300 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.626 1.256 -4.899 1.00 0.00 C ATOM 1306 C PRO A 121 -8.483 0.768 -6.344 1.00 0.00 C ATOM 1307 O PRO A 121 -9.396 0.134 -6.872 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.589 2.452 -4.845 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.732 3.639 -4.566 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.600 3.123 -3.736 1.00 0.00 C ATOM 0 HA PRO A 121 -8.959 0.372 -4.356 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.125 2.567 -5.787 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.339 2.317 -4.066 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.369 4.088 -5.491 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.289 4.410 -4.035 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.711 3.747 -3.827 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.856 3.085 -2.677 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.363 1.069 -6.996 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.180 0.648 -8.387 1.00 0.00 C ATOM 1320 C PHE A 122 -6.589 -0.755 -8.497 1.00 0.00 C ATOM 1321 O PHE A 122 -6.526 -1.313 -9.593 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.311 1.635 -9.188 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.534 2.629 -8.368 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -4.150 2.626 -8.403 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -6.180 3.571 -7.581 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -3.423 3.541 -7.669 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -5.457 4.488 -6.842 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.076 4.473 -6.886 1.00 0.00 C ATOM 0 H PHE A 122 -6.583 1.591 -6.597 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.180 0.637 -8.820 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.609 1.063 -9.795 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.955 2.183 -9.876 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -3.633 1.899 -9.012 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -7.259 3.588 -7.545 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -2.344 3.528 -7.707 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -5.971 5.215 -6.231 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.508 5.188 -6.309 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.160 -1.333 -7.381 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.588 -2.673 -7.411 1.00 0.00 C ATOM 1340 C TRP A 123 -6.577 -3.713 -6.890 1.00 0.00 C ATOM 1341 O TRP A 123 -6.294 -4.909 -6.914 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.300 -2.715 -6.599 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.264 -1.759 -7.084 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.185 -1.172 -8.313 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.159 -1.273 -6.333 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.088 -0.343 -8.366 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.444 -0.389 -7.158 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.707 -1.500 -5.038 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.302 0.269 -6.720 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.577 -0.849 -4.606 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.112 0.026 -5.441 1.00 0.00 C ATOM 0 H TRP A 123 -6.196 -0.902 -6.457 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.362 -2.917 -8.449 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.529 -2.494 -5.557 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -3.893 -3.726 -6.628 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.880 -1.334 -9.124 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.802 0.214 -9.171 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.235 -2.177 -4.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.238 0.946 -7.365 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.217 -1.019 -3.602 1.00 0.00 H new ATOM 0 HH2 TRP A 123 0.995 0.525 -5.069 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.745 -3.261 -6.429 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.765 -4.171 -5.921 1.00 0.00 C ATOM 1364 C GLU A 124 -9.027 -5.289 -6.924 1.00 0.00 C ATOM 1365 O GLU A 124 -9.339 -6.419 -6.548 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.059 -3.412 -5.631 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.653 -3.735 -4.273 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.924 -4.556 -4.373 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -12.974 -4.085 -3.888 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -11.869 -5.670 -4.934 1.00 0.00 O ATOM 0 H GLU A 124 -8.004 -2.275 -6.398 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.402 -4.612 -4.993 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -9.865 -2.341 -5.689 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.790 -3.646 -6.405 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -9.919 -4.280 -3.680 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -10.865 -2.806 -3.743 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.884 -4.962 -8.203 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.087 -5.931 -9.270 1.00 0.00 C ATOM 1379 C GLN A 125 -7.775 -6.637 -9.599 1.00 0.00 C ATOM 1380 O GLN A 125 -7.769 -7.778 -10.059 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.640 -5.240 -10.516 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.718 -4.169 -11.079 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.440 -2.866 -11.360 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.601 -2.862 -11.770 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -8.755 -1.750 -11.141 1.00 0.00 N ATOM 0 H GLN A 125 -8.627 -4.029 -8.526 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.810 -6.674 -8.932 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.824 -5.990 -11.285 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.602 -4.789 -10.274 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.907 -3.986 -10.374 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.263 -4.534 -12.000 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -7.795 -1.799 -10.801 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.189 -0.843 -11.313 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.665 -5.947 -9.350 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.343 -6.501 -9.608 1.00 0.00 C ATOM 1396 C TYR A 126 -4.906 -7.439 -8.481 1.00 0.00 C ATOM 1397 O TYR A 126 -3.873 -8.099 -8.582 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.314 -5.378 -9.761 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.726 -4.279 -10.723 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -5.780 -4.453 -11.613 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -4.049 -3.067 -10.740 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -6.148 -3.448 -12.489 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -4.411 -2.059 -11.612 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.460 -2.254 -12.483 1.00 0.00 C ATOM 1405 OH TYR A 126 -5.823 -1.251 -13.354 1.00 0.00 O ATOM 0 H TYR A 126 -6.657 -5.001 -8.969 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.400 -7.072 -10.535 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.127 -4.936 -8.782 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.372 -5.808 -10.101 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -6.320 -5.388 -11.620 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -3.225 -2.910 -10.060 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -6.970 -3.598 -13.174 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -3.874 -1.122 -11.611 1.00 0.00 H new ATOM 0 HH TYR A 126 -5.239 -0.475 -13.221 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.689 -7.486 -7.402 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.361 -8.335 -6.263 1.00 0.00 C ATOM 1417 C ILE A 127 -5.963 -9.732 -6.400 1.00 0.00 C ATOM 1418 O ILE A 127 -7.181 -9.905 -6.387 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.831 -7.707 -4.933 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.328 -7.393 -4.976 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -5.038 -6.446 -4.628 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -8.035 -7.685 -3.670 1.00 0.00 C ATOM 0 H ILE A 127 -6.549 -6.948 -7.296 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.275 -8.422 -6.252 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.655 -8.432 -4.138 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.465 -6.342 -5.229 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.792 -7.976 -5.772 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -5.383 -6.018 -3.687 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -3.979 -6.693 -4.548 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.182 -5.723 -5.430 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -9.093 -7.441 -3.767 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.927 -8.742 -3.426 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.595 -7.083 -2.875 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.092 -10.727 -6.523 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.515 -12.118 -6.652 1.00 0.00 C ATOM 1436 C ASN A 128 -5.266 -12.875 -5.348 1.00 0.00 C ATOM 1437 O ASN A 128 -4.966 -12.267 -4.321 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.761 -12.794 -7.801 1.00 0.00 C ATOM 1439 CG ASN A 128 -4.696 -11.926 -9.044 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -3.796 -10.947 -9.043 1.00 0.00 O flip ATOM 1441 ND2 ASN A 128 -5.447 -12.133 -9.998 1.00 0.00 N flip ATOM 0 H ASN A 128 -4.081 -10.595 -6.536 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.583 -12.136 -6.868 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -3.749 -13.033 -7.476 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.249 -13.738 -8.046 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -6.124 -12.895 -9.958 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.392 -11.542 -10.828 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.383 -14.203 -5.391 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.158 -15.027 -4.201 1.00 0.00 C ATOM 1450 C ASP A 129 -3.836 -14.649 -3.541 1.00 0.00 C ATOM 1451 O ASP A 129 -3.797 -14.273 -2.371 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.153 -16.511 -4.573 1.00 0.00 C ATOM 1453 CG ASP A 129 -5.358 -17.409 -3.368 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -4.813 -18.533 -3.365 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -6.065 -16.989 -2.428 1.00 0.00 O ATOM 0 H ASP A 129 -5.630 -14.728 -6.230 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.969 -14.846 -3.496 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.939 -16.702 -5.303 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.206 -16.760 -5.051 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.764 -14.722 -4.318 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.435 -14.357 -3.844 1.00 0.00 C ATOM 1462 C GLU A 130 -0.866 -13.299 -4.777 1.00 0.00 C ATOM 1463 O GLU A 130 -0.853 -13.490 -5.993 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.520 -15.584 -3.801 1.00 0.00 C ATOM 1465 CG GLU A 130 0.193 -15.765 -2.471 1.00 0.00 C ATOM 1466 CD GLU A 130 0.023 -17.160 -1.901 1.00 0.00 C ATOM 1467 OE1 GLU A 130 -0.593 -17.290 -0.822 1.00 0.00 O ATOM 1468 OE2 GLU A 130 0.505 -18.123 -2.535 1.00 0.00 O ATOM 0 H GLU A 130 -2.790 -15.034 -5.289 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.502 -13.961 -2.831 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.111 -16.475 -4.011 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.223 -15.500 -4.594 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.255 -15.557 -2.602 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -0.189 -15.036 -1.756 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.434 -12.168 -4.229 1.00 0.00 N ATOM 1476 CA ASN A 131 0.080 -11.097 -5.071 1.00 0.00 C ATOM 1477 C ASN A 131 1.417 -10.564 -4.599 1.00 0.00 C ATOM 1478 O ASN A 131 1.701 -10.507 -3.403 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.915 -9.934 -5.122 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.358 -10.388 -5.039 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.709 -11.467 -5.513 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -3.203 -9.560 -4.437 1.00 0.00 N ATOM 0 H ASN A 131 -0.429 -11.972 -3.228 1.00 0.00 H new ATOM 0 HA ASN A 131 0.219 -11.531 -6.061 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.707 -9.249 -4.300 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.767 -9.377 -6.047 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.189 -9.809 -4.353 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.867 -8.675 -4.058 1.00 0.00 H new ATOM 1489 N THR A 132 2.207 -10.120 -5.564 1.00 0.00 N ATOM 1490 CA THR A 132 3.495 -9.519 -5.283 1.00 0.00 C ATOM 1491 C THR A 132 3.245 -8.083 -4.860 1.00 0.00 C ATOM 1492 O THR A 132 2.894 -7.234 -5.687 1.00 0.00 O ATOM 1493 CB THR A 132 4.401 -9.567 -6.514 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.214 -10.776 -7.228 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.872 -9.453 -6.179 1.00 0.00 C ATOM 0 H THR A 132 1.973 -10.167 -6.556 1.00 0.00 H new ATOM 0 HA THR A 132 4.002 -10.069 -4.491 1.00 0.00 H new ATOM 0 HB THR A 132 4.115 -8.705 -7.117 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.801 -10.787 -8.013 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.458 -9.494 -7.097 1.00 0.00 H new ATOM 0 HG22 THR A 132 6.057 -8.506 -5.672 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.161 -10.277 -5.526 1.00 0.00 H new ATOM 1503 N VAL A 133 3.369 -7.826 -3.565 1.00 0.00 N ATOM 1504 CA VAL A 133 3.099 -6.501 -3.028 1.00 0.00 C ATOM 1505 C VAL A 133 4.347 -5.820 -2.490 1.00 0.00 C ATOM 1506 O VAL A 133 5.087 -6.384 -1.684 1.00 0.00 O ATOM 1507 CB VAL A 133 2.039 -6.544 -1.898 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.710 -5.997 -2.390 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.864 -7.955 -1.351 1.00 0.00 C ATOM 0 H VAL A 133 3.654 -8.516 -2.870 1.00 0.00 H new ATOM 0 HA VAL A 133 2.718 -5.923 -3.870 1.00 0.00 H new ATOM 0 HB VAL A 133 2.397 -5.913 -1.085 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -0.021 -6.036 -1.582 1.00 0.00 H new ATOM 0 HG12 VAL A 133 0.839 -4.964 -2.713 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.357 -6.598 -3.228 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.114 -7.948 -0.560 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.540 -8.619 -2.153 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.813 -8.309 -0.948 1.00 0.00 H new ATOM 1519 N GLU A 134 4.537 -4.579 -2.915 1.00 0.00 N ATOM 1520 CA GLU A 134 5.651 -3.769 -2.457 1.00 0.00 C ATOM 1521 C GLU A 134 5.091 -2.598 -1.671 1.00 0.00 C ATOM 1522 O GLU A 134 4.357 -1.770 -2.215 1.00 0.00 O ATOM 1523 CB GLU A 134 6.493 -3.269 -3.626 1.00 0.00 C ATOM 1524 CG GLU A 134 6.753 -4.325 -4.687 1.00 0.00 C ATOM 1525 CD GLU A 134 7.151 -3.725 -6.020 1.00 0.00 C ATOM 1526 OE1 GLU A 134 7.977 -2.787 -6.027 1.00 0.00 O ATOM 1527 OE2 GLU A 134 6.639 -4.191 -7.059 1.00 0.00 O ATOM 0 H GLU A 134 3.926 -4.110 -3.583 1.00 0.00 H new ATOM 0 HA GLU A 134 6.303 -4.374 -1.827 1.00 0.00 H new ATOM 0 HB2 GLU A 134 5.990 -2.419 -4.087 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.448 -2.906 -3.246 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.542 -4.994 -4.343 1.00 0.00 H new ATOM 0 HG3 GLU A 134 5.857 -4.931 -4.819 1.00 0.00 H new ATOM 1534 N LEU A 135 5.397 -2.557 -0.385 1.00 0.00 N ATOM 1535 CA LEU A 135 4.870 -1.506 0.474 1.00 0.00 C ATOM 1536 C LEU A 135 5.923 -0.915 1.398 1.00 0.00 C ATOM 1537 O LEU A 135 6.873 -1.584 1.798 1.00 0.00 O ATOM 1538 CB LEU A 135 3.716 -2.060 1.313 1.00 0.00 C ATOM 1539 CG LEU A 135 3.947 -3.458 1.897 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.648 -3.372 3.243 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.628 -4.205 2.025 1.00 0.00 C ATOM 0 H LEU A 135 6.001 -3.231 0.085 1.00 0.00 H new ATOM 0 HA LEU A 135 4.524 -0.705 -0.179 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.519 -1.369 2.133 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.818 -2.085 0.695 1.00 0.00 H new ATOM 0 HG LEU A 135 4.592 -4.012 1.215 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.801 -4.376 3.638 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.612 -2.879 3.120 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.034 -2.799 3.937 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.810 -5.196 2.441 1.00 0.00 H new ATOM 0 HD22 LEU A 135 1.959 -3.652 2.684 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.169 -4.303 1.041 1.00 0.00 H new ATOM 1553 N ILE A 136 5.707 0.343 1.762 1.00 0.00 N ATOM 1554 CA ILE A 136 6.591 1.052 2.674 1.00 0.00 C ATOM 1555 C ILE A 136 5.870 1.229 4.000 1.00 0.00 C ATOM 1556 O ILE A 136 4.675 1.500 4.016 1.00 0.00 O ATOM 1557 CB ILE A 136 7.016 2.437 2.131 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.681 2.587 0.643 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.502 2.643 2.351 1.00 0.00 C ATOM 1560 CD1 ILE A 136 6.640 4.028 0.182 1.00 0.00 C ATOM 0 H ILE A 136 4.916 0.898 1.434 1.00 0.00 H new ATOM 0 HA ILE A 136 7.500 0.462 2.793 1.00 0.00 H new ATOM 0 HB ILE A 136 6.457 3.197 2.677 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.421 2.045 0.054 1.00 0.00 H new ATOM 0 HG13 ILE A 136 5.715 2.122 0.446 1.00 0.00 H new ATOM 0 HG21 ILE A 136 8.795 3.620 1.966 1.00 0.00 H new ATOM 0 HG22 ILE A 136 8.723 2.592 3.417 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.059 1.865 1.828 1.00 0.00 H new ATOM 0 HD11 ILE A 136 6.398 4.063 -0.880 1.00 0.00 H new ATOM 0 HD12 ILE A 136 5.880 4.569 0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 136 7.613 4.491 0.348 1.00 0.00 H new ATOM 1572 N HIS A 137 6.570 1.051 5.109 1.00 0.00 N ATOM 1573 CA HIS A 137 5.933 1.165 6.413 1.00 0.00 C ATOM 1574 C HIS A 137 5.926 2.600 6.913 1.00 0.00 C ATOM 1575 O HIS A 137 6.974 3.199 7.151 1.00 0.00 O ATOM 1576 CB HIS A 137 6.612 0.227 7.405 1.00 0.00 C ATOM 1577 CG HIS A 137 6.717 -1.174 6.878 1.00 0.00 C ATOM 1578 ND1 HIS A 137 7.228 -1.641 5.714 1.00 0.00 N flip ATOM 1579 CD2 HIS A 137 6.229 -2.279 7.545 1.00 0.00 C flip ATOM 1580 CE1 HIS A 137 7.044 -2.998 5.698 1.00 0.00 C flip ATOM 1581 NE2 HIS A 137 6.439 -3.360 6.810 1.00 0.00 N flip ATOM 0 H HIS A 137 7.565 0.830 5.135 1.00 0.00 H new ATOM 0 HA HIS A 137 4.889 0.867 6.313 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.609 0.603 7.634 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.051 0.221 8.340 1.00 0.00 H new ATOM 0 HD2 HIS A 137 5.751 -2.264 8.513 1.00 0.00 H new ATOM 0 HE1 HIS A 137 7.346 -3.663 4.903 1.00 0.00 H new ATOM 0 HE2 HIS A 137 6.176 -4.313 7.063 1.00 0.00 H new ATOM 1590 N THR A 138 4.723 3.148 7.059 1.00 0.00 N ATOM 1591 CA THR A 138 4.558 4.521 7.518 1.00 0.00 C ATOM 1592 C THR A 138 4.469 4.570 9.042 1.00 0.00 C ATOM 1593 O THR A 138 4.868 3.627 9.725 1.00 0.00 O ATOM 1594 CB THR A 138 3.304 5.149 6.889 1.00 0.00 C ATOM 1595 OG1 THR A 138 2.196 5.055 7.767 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.894 4.523 5.572 1.00 0.00 C ATOM 0 H THR A 138 3.848 2.661 6.866 1.00 0.00 H new ATOM 0 HA THR A 138 5.430 5.096 7.205 1.00 0.00 H new ATOM 0 HB THR A 138 3.581 6.187 6.703 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.782 4.171 7.678 1.00 0.00 H new ATOM 0 HG21 THR A 138 2.002 5.022 5.194 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.703 4.631 4.850 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.681 3.465 5.723 1.00 0.00 H new ATOM 1604 N ASP A 139 3.938 5.670 9.569 1.00 0.00 N ATOM 1605 CA ASP A 139 3.794 5.827 11.011 1.00 0.00 C ATOM 1606 C ASP A 139 2.641 4.973 11.537 1.00 0.00 C ATOM 1607 O ASP A 139 2.452 4.847 12.747 1.00 0.00 O ATOM 1608 CB ASP A 139 3.558 7.296 11.366 1.00 0.00 C ATOM 1609 CG ASP A 139 3.804 7.582 12.834 1.00 0.00 C ATOM 1610 OD1 ASP A 139 3.020 7.092 13.674 1.00 0.00 O ATOM 1611 OD2 ASP A 139 4.781 8.296 13.145 1.00 0.00 O ATOM 0 H ASP A 139 3.602 6.462 9.021 1.00 0.00 H new ATOM 0 HA ASP A 139 4.718 5.492 11.482 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.214 7.923 10.762 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.534 7.568 11.112 1.00 0.00 H new ATOM 1616 N SER A 140 1.873 4.389 10.620 1.00 0.00 N ATOM 1617 CA SER A 140 0.740 3.550 10.991 1.00 0.00 C ATOM 1618 C SER A 140 0.833 2.183 10.320 1.00 0.00 C ATOM 1619 O SER A 140 1.225 1.197 10.942 1.00 0.00 O ATOM 1620 CB SER A 140 -0.572 4.237 10.604 1.00 0.00 C ATOM 1621 OG SER A 140 -0.600 4.546 9.219 1.00 0.00 O ATOM 0 H SER A 140 2.016 4.483 9.614 1.00 0.00 H new ATOM 0 HA SER A 140 0.762 3.404 12.071 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.412 3.588 10.852 1.00 0.00 H new ATOM 0 HB3 SER A 140 -0.693 5.151 11.186 1.00 0.00 H new ATOM 0 HG SER A 140 -1.525 4.521 8.897 1.00 0.00 H new ATOM 1627 N LEU A 141 0.470 2.137 9.045 1.00 0.00 N ATOM 1628 CA LEU A 141 0.509 0.899 8.276 1.00 0.00 C ATOM 1629 C LEU A 141 1.371 1.066 7.029 1.00 0.00 C ATOM 1630 O LEU A 141 1.790 2.177 6.696 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.909 0.478 7.878 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.841 1.629 7.483 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -2.634 1.271 6.234 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.779 1.973 8.631 1.00 0.00 C ATOM 0 H LEU A 141 0.143 2.947 8.519 1.00 0.00 H new ATOM 0 HA LEU A 141 0.949 0.122 8.901 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.844 -0.219 7.043 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.358 -0.063 8.711 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.231 2.505 7.262 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.290 2.100 5.969 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -1.947 1.075 5.411 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.234 0.381 6.426 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.434 2.792 8.333 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.382 1.100 8.883 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -2.195 2.273 9.501 1.00 0.00 H new ATOM 1646 N PRO A 142 1.672 -0.039 6.332 1.00 0.00 N ATOM 1647 CA PRO A 142 2.494 -0.014 5.132 1.00 0.00 C ATOM 1648 C PRO A 142 1.703 0.374 3.890 1.00 0.00 C ATOM 1649 O PRO A 142 0.709 -0.267 3.541 1.00 0.00 O ATOM 1650 CB PRO A 142 3.002 -1.457 4.997 1.00 0.00 C ATOM 1651 CG PRO A 142 2.458 -2.192 6.177 1.00 0.00 C ATOM 1652 CD PRO A 142 1.272 -1.404 6.660 1.00 0.00 C ATOM 0 HA PRO A 142 3.289 0.727 5.215 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.660 -1.906 4.065 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.091 -1.488 4.985 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.165 -3.205 5.902 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.211 -2.280 6.960 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.353 -1.695 6.152 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.101 -1.535 7.728 1.00 0.00 H new ATOM 1660 N LEU A 143 2.170 1.410 3.216 1.00 0.00 N ATOM 1661 CA LEU A 143 1.539 1.879 1.991 1.00 0.00 C ATOM 1662 C LEU A 143 2.068 1.082 0.809 1.00 0.00 C ATOM 1663 O LEU A 143 3.262 1.110 0.515 1.00 0.00 O ATOM 1664 CB LEU A 143 1.805 3.368 1.768 1.00 0.00 C ATOM 1665 CG LEU A 143 0.889 4.051 0.745 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.106 3.493 -0.653 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.562 3.889 1.141 1.00 0.00 C ATOM 0 H LEU A 143 2.990 1.947 3.498 1.00 0.00 H new ATOM 0 HA LEU A 143 0.462 1.735 2.083 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.706 3.885 2.722 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.839 3.491 1.445 1.00 0.00 H new ATOM 0 HG LEU A 143 1.142 5.111 0.734 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.441 3.998 -1.354 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.141 3.656 -0.953 1.00 0.00 H new ATOM 0 HD13 LEU A 143 0.891 2.424 -0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.197 4.380 0.404 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.811 2.829 1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.725 4.342 2.119 1.00 0.00 H new ATOM 1679 N VAL A 144 1.179 0.370 0.142 1.00 0.00 N ATOM 1680 CA VAL A 144 1.564 -0.438 -1.003 1.00 0.00 C ATOM 1681 C VAL A 144 1.815 0.445 -2.218 1.00 0.00 C ATOM 1682 O VAL A 144 0.879 0.875 -2.893 1.00 0.00 O ATOM 1683 CB VAL A 144 0.494 -1.495 -1.328 1.00 0.00 C ATOM 1684 CG1 VAL A 144 1.041 -2.523 -2.306 1.00 0.00 C ATOM 1685 CG2 VAL A 144 0.006 -2.172 -0.056 1.00 0.00 C ATOM 0 H VAL A 144 0.186 0.334 0.372 1.00 0.00 H new ATOM 0 HA VAL A 144 2.487 -0.959 -0.746 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.354 -0.994 -1.795 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.271 -3.263 -2.525 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.338 -2.025 -3.229 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.906 -3.019 -1.866 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.750 -2.916 -0.307 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.844 -2.660 0.441 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.426 -1.426 0.610 1.00 0.00 H new ATOM 1695 N ILE A 145 3.089 0.730 -2.474 1.00 0.00 N ATOM 1696 CA ILE A 145 3.478 1.583 -3.590 1.00 0.00 C ATOM 1697 C ILE A 145 3.392 0.857 -4.927 1.00 0.00 C ATOM 1698 O ILE A 145 3.216 1.489 -5.969 1.00 0.00 O ATOM 1699 CB ILE A 145 4.908 2.128 -3.410 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.879 0.992 -3.079 1.00 0.00 C ATOM 1701 CG2 ILE A 145 4.934 3.188 -2.321 1.00 0.00 C ATOM 1702 CD1 ILE A 145 7.156 1.035 -3.889 1.00 0.00 C ATOM 0 H ILE A 145 3.871 0.380 -1.921 1.00 0.00 H new ATOM 0 HA ILE A 145 2.770 2.412 -3.596 1.00 0.00 H new ATOM 0 HB ILE A 145 5.226 2.586 -4.347 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.129 1.035 -2.019 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.381 0.038 -3.250 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.950 3.565 -2.204 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.272 4.009 -2.597 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.598 2.752 -1.380 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.797 0.201 -3.602 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.917 0.961 -4.950 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.676 1.974 -3.699 1.00 0.00 H new ATOM 1714 N SER A 146 3.519 -0.465 -4.905 1.00 0.00 N ATOM 1715 CA SER A 146 3.453 -1.238 -6.141 1.00 0.00 C ATOM 1716 C SER A 146 2.790 -2.593 -5.926 1.00 0.00 C ATOM 1717 O SER A 146 2.700 -3.088 -4.802 1.00 0.00 O ATOM 1718 CB SER A 146 4.854 -1.428 -6.726 1.00 0.00 C ATOM 1719 OG SER A 146 5.853 -1.018 -5.809 1.00 0.00 O ATOM 0 H SER A 146 3.666 -1.017 -4.060 1.00 0.00 H new ATOM 0 HA SER A 146 2.841 -0.675 -6.846 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.003 -2.476 -6.986 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.946 -0.855 -7.649 1.00 0.00 H new ATOM 0 HG SER A 146 6.684 -0.831 -6.293 1.00 0.00 H new ATOM 1725 N LEU A 147 2.335 -3.188 -7.024 1.00 0.00 N ATOM 1726 CA LEU A 147 1.686 -4.488 -6.989 1.00 0.00 C ATOM 1727 C LEU A 147 2.118 -5.306 -8.198 1.00 0.00 C ATOM 1728 O LEU A 147 2.653 -4.758 -9.160 1.00 0.00 O ATOM 1729 CB LEU A 147 0.164 -4.323 -6.981 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.591 -5.313 -6.094 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.797 -4.731 -4.705 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -1.927 -5.682 -6.721 1.00 0.00 C ATOM 0 H LEU A 147 2.407 -2.783 -7.957 1.00 0.00 H new ATOM 0 HA LEU A 147 1.982 -5.009 -6.078 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.074 -3.311 -6.654 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.202 -4.422 -8.003 1.00 0.00 H new ATOM 0 HG LEU A 147 0.007 -6.220 -6.004 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.336 -5.448 -4.086 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.171 -4.517 -4.253 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.374 -3.809 -4.779 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.450 -6.387 -6.075 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.532 -4.784 -6.842 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.757 -6.140 -7.696 1.00 0.00 H new ATOM 1744 N ASN A 148 1.904 -6.614 -8.148 1.00 0.00 N ATOM 1745 CA ASN A 148 2.300 -7.478 -9.255 1.00 0.00 C ATOM 1746 C ASN A 148 1.783 -6.953 -10.605 1.00 0.00 C ATOM 1747 O ASN A 148 0.623 -7.149 -10.965 1.00 0.00 O ATOM 1748 CB ASN A 148 1.823 -8.920 -9.001 1.00 0.00 C ATOM 1749 CG ASN A 148 0.446 -9.225 -9.570 1.00 0.00 C ATOM 1750 OD1 ASN A 148 0.316 -9.601 -10.735 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.586 -9.067 -8.751 1.00 0.00 N ATOM 0 H ASN A 148 1.464 -7.096 -7.364 1.00 0.00 H new ATOM 0 HA ASN A 148 3.389 -7.475 -9.309 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.545 -9.612 -9.434 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.810 -9.104 -7.927 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.532 -9.259 -9.080 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.433 -8.753 -7.793 1.00 0.00 H new ATOM 1758 N GLY A 149 2.669 -6.302 -11.355 1.00 0.00 N ATOM 1759 CA GLY A 149 2.302 -5.786 -12.667 1.00 0.00 C ATOM 1760 C GLY A 149 1.657 -4.408 -12.642 1.00 0.00 C ATOM 1761 O GLY A 149 1.276 -3.887 -13.690 1.00 0.00 O ATOM 0 H GLY A 149 3.634 -6.122 -11.079 1.00 0.00 H new ATOM 0 HA2 GLY A 149 3.195 -5.745 -13.291 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.615 -6.487 -13.141 1.00 0.00 H new ATOM 1765 N HIS A 150 1.529 -3.811 -11.462 1.00 0.00 N ATOM 1766 CA HIS A 150 0.920 -2.487 -11.352 1.00 0.00 C ATOM 1767 C HIS A 150 1.693 -1.604 -10.385 1.00 0.00 C ATOM 1768 O HIS A 150 2.473 -2.092 -9.567 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.534 -2.599 -10.901 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.273 -3.711 -11.569 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.065 -3.535 -12.683 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.328 -5.027 -11.274 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.578 -4.698 -13.044 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.145 -5.621 -12.204 1.00 0.00 N ATOM 0 H HIS A 150 1.834 -4.216 -10.577 1.00 0.00 H new ATOM 0 HA HIS A 150 0.952 -2.027 -12.340 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.562 -2.749 -9.822 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.045 -1.658 -11.105 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.823 -5.521 -10.457 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.238 -4.865 -13.882 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.379 -6.613 -12.240 1.00 0.00 H new ATOM 1783 N THR A 151 1.476 -0.298 -10.490 1.00 0.00 N ATOM 1784 CA THR A 151 2.156 0.655 -9.629 1.00 0.00 C ATOM 1785 C THR A 151 1.255 1.837 -9.288 1.00 0.00 C ATOM 1786 O THR A 151 0.309 2.143 -10.013 1.00 0.00 O ATOM 1787 CB THR A 151 3.436 1.142 -10.299 1.00 0.00 C ATOM 1788 OG1 THR A 151 3.143 2.071 -11.327 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.250 0.019 -10.907 1.00 0.00 C ATOM 0 H THR A 151 0.835 0.122 -11.163 1.00 0.00 H new ATOM 0 HA THR A 151 2.409 0.149 -8.697 1.00 0.00 H new ATOM 0 HB THR A 151 4.022 1.608 -9.507 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.978 2.373 -11.743 1.00 0.00 H new ATOM 0 HG21 THR A 151 5.148 0.429 -11.368 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.533 -0.688 -10.128 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.655 -0.493 -11.663 1.00 0.00 H new ATOM 1797 N LEU A 152 1.553 2.487 -8.168 1.00 0.00 N ATOM 1798 CA LEU A 152 0.772 3.627 -7.705 1.00 0.00 C ATOM 1799 C LEU A 152 0.854 4.790 -8.683 1.00 0.00 C ATOM 1800 O LEU A 152 -0.141 5.465 -8.947 1.00 0.00 O ATOM 1801 CB LEU A 152 1.262 4.065 -6.322 1.00 0.00 C ATOM 1802 CG LEU A 152 0.348 3.683 -5.158 1.00 0.00 C ATOM 1803 CD1 LEU A 152 0.997 4.043 -3.829 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.000 4.368 -5.298 1.00 0.00 C ATOM 0 H LEU A 152 2.335 2.241 -7.561 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.272 3.319 -7.639 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.246 3.630 -6.148 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.388 5.148 -6.325 1.00 0.00 H new ATOM 0 HG LEU A 152 0.191 2.605 -5.180 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.332 3.764 -3.012 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.941 3.507 -3.728 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.184 5.116 -3.794 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.640 4.086 -4.462 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.860 5.449 -5.300 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.469 4.061 -6.233 1.00 0.00 H new ATOM 1816 N GLN A 153 2.043 5.015 -9.221 1.00 0.00 N ATOM 1817 CA GLN A 153 2.253 6.095 -10.176 1.00 0.00 C ATOM 1818 C GLN A 153 2.831 5.556 -11.478 1.00 0.00 C ATOM 1819 O GLN A 153 4.018 5.720 -11.760 1.00 0.00 O ATOM 1820 CB GLN A 153 3.177 7.171 -9.590 1.00 0.00 C ATOM 1821 CG GLN A 153 4.239 6.635 -8.640 1.00 0.00 C ATOM 1822 CD GLN A 153 5.643 7.061 -9.030 1.00 0.00 C ATOM 1823 OE1 GLN A 153 5.783 8.294 -9.508 1.00 0.00 O flip ATOM 1824 NE2 GLN A 153 6.594 6.288 -8.905 1.00 0.00 N flip ATOM 0 H GLN A 153 2.877 4.466 -9.014 1.00 0.00 H new ATOM 0 HA GLN A 153 1.285 6.550 -10.387 1.00 0.00 H new ATOM 0 HB2 GLN A 153 3.670 7.695 -10.409 1.00 0.00 H new ATOM 0 HB3 GLN A 153 2.570 7.906 -9.061 1.00 0.00 H new ATOM 0 HG2 GLN A 153 4.026 6.983 -7.629 1.00 0.00 H new ATOM 0 HG3 GLN A 153 4.186 5.546 -8.620 1.00 0.00 H new ATOM 0 HE21 GLN A 153 6.443 5.350 -8.534 1.00 0.00 H new ATOM 0 HE22 GLN A 153 7.532 6.586 -9.173 1.00 0.00 H new ATOM 1833 N GLU A 154 1.977 4.913 -12.267 1.00 0.00 N ATOM 1834 CA GLU A 154 2.393 4.347 -13.545 1.00 0.00 C ATOM 1835 C GLU A 154 2.194 5.351 -14.676 1.00 0.00 C ATOM 1836 O GLU A 154 2.739 5.118 -15.775 1.00 0.00 O ATOM 1837 CB GLU A 154 1.608 3.066 -13.840 1.00 0.00 C ATOM 1838 CG GLU A 154 0.108 3.212 -13.644 1.00 0.00 C ATOM 1839 CD GLU A 154 -0.668 2.027 -14.184 1.00 0.00 C ATOM 1840 OE1 GLU A 154 -0.585 1.769 -15.403 1.00 0.00 O ATOM 1841 OE2 GLU A 154 -1.359 1.357 -13.387 1.00 0.00 O ATOM 1842 OXT GLU A 154 1.492 6.360 -14.453 1.00 0.00 O ATOM 0 H GLU A 154 0.992 4.771 -12.044 1.00 0.00 H new ATOM 0 HA GLU A 154 3.454 4.107 -13.479 1.00 0.00 H new ATOM 0 HB2 GLU A 154 1.803 2.759 -14.867 1.00 0.00 H new ATOM 0 HB3 GLU A 154 1.974 2.268 -13.194 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -0.106 3.328 -12.582 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -0.233 4.121 -14.139 1.00 0.00 H new TER 1849 GLU A 154